Detailed information for compound 678138

Basic information

Technical information
  • TDR Targets ID: 678138
  • Name: N-(2-chlorophenyl)-N-[2-[4-(4-fluorophenyl)pi perazin-1-yl]-2-oxoethyl]methanesulfonamide
  • MW: 425.905 | Formula: C19H21ClFN3O3S
  • H donors: 0 H acceptors: 3 LogP: 2.92 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1ccccc1Cl
  • InChi: 1S/C19H21ClFN3O3S/c1-28(26,27)24(18-5-3-2-4-17(18)20)14-19(25)23-12-10-22(11-13-23)16-8-6-15(21)7-9-16/h2-9H,10-14H2,1H3
  • InChiKey: DLLZJPGNUDCUQY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-chlorophenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide
  • N-(2-chlorophenyl)-N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide
  • N-(2-chlorophenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-keto-ethyl]methanesulfonamide
  • ZINC00916630
  • BAS 03564754

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 tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0267 0.0267
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0267 0.0271
Schistosoma mansoni growth factor receptor-bound protein 0.0007 0.0071 0.0072
Echinococcus granulosus tyrosine protein kinase Src64B 0.0008 0.0123 0.0123
Schistosoma mansoni tyrosine kinase 0.0008 0.0123 0.0125
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Echinococcus granulosus tyrosine protein kinase Lyn 0.0008 0.0123 0.0123
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0267 0.0267
Trypanosoma brucei transcription factor BTF3, putative 0.0038 0.1656 0.9476
Schistosoma mansoni cpg binding protein 0.0033 0.1399 0.1424
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0015 0.0454 0.2347
Loa Loa (eye worm) hypothetical protein 0.0134 0.655 0.7436
Schistosoma mansoni tar DNA-binding protein 0.007 0.3243 0.3303
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Schistosoma mansoni hypothetical protein 0.0012 0.0334 0.034
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0267 0.0267
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0067 0.3107 0.3165
Schistosoma mansoni nck2/grb4 0.0007 0.0071 0.0072
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.1656 0.9599
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.01 0.01
Loa Loa (eye worm) SRC-1 0.0008 0.0123 0.014
Brugia malayi hypothetical protein 0.0028 0.1111 0.1261
Brugia malayi Glycosyl hydrolases family 31 protein 0.0015 0.0454 0.0516
Trichomonas vaginalis alpha-glucosidase, putative 0.0015 0.0454 0.2347
Schistosoma mansoni alpha-glucosidase 0.0154 0.7541 0.7681
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0267 0.0267
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.1111 0.5175
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0192 0.0218
Trichomonas vaginalis alpha-glucosidase, putative 0.0015 0.0454 0.2347
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1723 1
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0008 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0134 0.655 0.7436
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0267 0.0267
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0008 0.0123 0.0125
Schistosoma mansoni alpha-glucosidase 0.0154 0.7541 0.7681
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0267 0.0303
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0267 0.0303
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0267 0.0267
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0267 0.0267
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0267 0.0303
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0008 0.0123 0.0123
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.01 0.01
Schistosoma mansoni adapter molecule crk 0.0007 0.0071 0.0072
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1723 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.1111 0.5175
Schistosoma mansoni tar DNA-binding protein 0.007 0.3243 0.3303
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0267 0.0271
Brugia malayi CXXC zinc finger family protein 0.0032 0.1307 0.1484
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0267 0.0303
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0267 0.0271
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0267 0.0303
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0267 0.0267
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.1723 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0267 0.0303
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0267 0.0271
Echinococcus granulosus cpg binding protein 0.0033 0.1399 0.1399
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0008 0.0123 0.0123
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.1723 0.3748
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.1111 0.5175
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0267 0.0267
Trichomonas vaginalis alpha-glucosidase, putative 0.0015 0.0454 0.2347
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0267 0.0303
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0267 0.0267
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.1723 0.1723
Schistosoma mansoni tyrosine kinase 0.0008 0.0123 0.0125
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0267 0.0267
Onchocerca volvulus Huntingtin homolog 0.0134 0.655 0.7972
Schistosoma mansoni tyrosine kinase 0.0008 0.0123 0.0125
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0334 0.0334
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0334 0.0334
Schistosoma mansoni growth factor receptor-bound protein 0.0007 0.0071 0.0072
Brugia malayi Glycosyl hydrolases family 31 protein 0.0179 0.8809 1
Entamoeba histolytica transcription factor BTF3, putative 0.0038 0.1656 0.9476
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.1723 1
Leishmania major alpha glucosidase II subunit, putative 0.004 0.1723 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Echinococcus granulosus NCK adaptor protein 0.0007 0.0071 0.0071
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0267 0.0271
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.2743 1
Brugia malayi Sex muscle abnormal protein 5 0.0007 0.0071 0.008
Leishmania major hypothetical protein, conserved 0.0028 0.1111 0.5175
Schistosoma mansoni coup transcription factor 0.0011 0.0267 0.0271
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0008 0.0123 0.0123
Echinococcus multilocularis cpg binding protein 0.0033 0.1399 0.1399
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0267 0.0271
Leishmania major basic transcription factor 3a, putative 0.0038 0.1656 0.9476
Echinococcus granulosus tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0267 0.0303
Echinococcus granulosus tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Loa Loa (eye worm) histone methyltransferase 0.001 0.0198 0.0225
Echinococcus granulosus tar DNA binding protein 0.007 0.3243 0.3243
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0267 0.0267
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1723 1
Onchocerca volvulus Huntingtin homolog 0.0134 0.655 0.7972
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0267 0.0303
Echinococcus multilocularis tyrosine protein kinase Abl 0.0008 0.0123 0.0123
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0267 0.0271
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.1723 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0015 0.0454 0.2347
Brugia malayi Variant SH3 domain containing protein 0.0007 0.0071 0.008
Onchocerca volvulus 0.0032 0.1307 0.132
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0267 0.0303
Echinococcus multilocularis c src tyrosine kinase 0.0008 0.0123 0.0123
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0267 0.0271
Echinococcus multilocularis transcription factor btf3 0.0038 0.1656 0.1656
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0267 0.0303
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0267 0.0303
Schistosoma mansoni tar DNA-binding protein 0.007 0.3243 0.3303
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0008 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0028 0.1111 0.1261
Brugia malayi ecdysteroid receptor 0.0011 0.0267 0.0303
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0015 0.0454 0.0238
Schistosoma mansoni cpg binding protein 0.0033 0.1399 0.1424
Schistosoma mansoni tyrosine kinase 0.0008 0.0123 0.0125
Echinococcus granulosus c src tyrosine kinase 0.0008 0.0123 0.0123
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.1723 0.1723
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.01 0.0102
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Plasmodium falciparum basic transcription factor 3b, putative 0.0038 0.1656 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.1307 0.1484
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0267 0.0303
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1723 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0267 0.0303
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0267 0.0267
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0267 0.0271
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0267 0.0271
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.01 0.01
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0267 0.0303
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0267 0.0303
Echinococcus granulosus lysosomal alpha glucosidase 0.0179 0.8809 0.8809
Brugia malayi beta-NAC-like protein 0.0038 0.1656 0.188
Schistosoma mansoni transcription factor btf3 0.0038 0.1656 0.1687
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0007 0.0071 0.0072
Trypanosoma cruzi transcription factor btf3, putative 0.0038 0.1656 0.9476
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0267 0.0303
Toxoplasma gondii NAC domain-containing protein 0.0038 0.1656 0.3341
Loa Loa (eye worm) ICD-1 protein 0.0038 0.1656 0.188
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.1723 0.1955
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.007 0.3243 0.3681
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1723 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0198 0.0198
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0007 0.0071 0.008
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0267 0.0267
Loa Loa (eye worm) TAR-binding protein 0.007 0.3243 0.3681
Plasmodium vivax basic transcription factor 3b, putative 0.0038 0.1656 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1723 1
Entamoeba histolytica hypothetical protein 0.0038 0.1656 0.9476
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0267 0.0271
Echinococcus multilocularis NCK adaptor protein 0.0007 0.0071 0.0071
Schistosoma mansoni alpha glucosidase 0.004 0.1723 0.1755
Schistosoma mansoni tar DNA-binding protein 0.007 0.3243 0.3303
Schistosoma mansoni tar DNA-binding protein 0.007 0.3243 0.3303
Echinococcus granulosus transcription factor btf3 0.0038 0.1656 0.1656
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0267 0.0267
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0202 1 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1723 1
Schistosoma mansoni cpg binding protein 0.0032 0.1307 0.1331
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0267 0.0303
Trichomonas vaginalis maltase-glucoamylase, putative 0.0015 0.0454 0.2347
Brugia malayi nuclear hormone receptor 0.0011 0.0267 0.0303
Brugia malayi TAR-binding protein 0.007 0.3243 0.3681
Brugia malayi steroid hormone receptor 0.0011 0.0267 0.0303
Onchocerca volvulus 0.0103 0.4969 0.5966
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0267 0.0303
Echinococcus granulosus tyrosine protein kinase Fyn 0.0008 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0166 0.8149 0.925
Echinococcus multilocularis tar DNA binding protein 0.007 0.3243 0.3243
Trichomonas vaginalis alpha-glucosidase, putative 0.0015 0.0454 0.2347
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.01 0.01
Echinococcus granulosus tyrosine protein kinase Src42A 0.0008 0.0123 0.0123
Trypanosoma brucei glucosidase, putative 0.004 0.1723 1
Brugia malayi Variant SH3 domain containing protein 0.0007 0.0071 0.008
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0267 0.0303
Brugia malayi nuclear receptor NHR-88 0.0011 0.0267 0.0303
Brugia malayi RNA binding protein 0.007 0.3243 0.3681
Brugia malayi Tyrosine-protein kinase abl-1 0.0008 0.0123 0.014
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0008 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0267 0.0303
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0008 0.0123 0.0123
Echinococcus granulosus growth factor receptor bound protein 2 0.0007 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0007 0.0071 0.008
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0008 0.0123 0.0123
Echinococcus multilocularis growth factor receptor bound protein 2 0.0007 0.0071 0.0071
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0267 0.0267
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0267 0.0267
Brugia malayi hypothetical protein 0.0166 0.8149 0.925
Schistosoma mansoni tyrosine kinase 0.0199 0.9818 1
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0007 0.0071 0.008
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.1656 0.9599
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0267 0.0267
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0179 0.8809 1
Brugia malayi hypothetical protein 0.0134 0.655 0.7436
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0267 0.0303
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0267 0.0303
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Onchocerca volvulus 0.0166 0.8149 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0267 0.0303
Brugia malayi SRC-1 0.0008 0.0123 0.014
Loa Loa (eye worm) hypothetical protein 0.0011 0.0267 0.0303
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.1656 0.9599
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.1723 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.1723 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0179 0.8809 0.8809
Trichomonas vaginalis alpha-glucosidase, putative 0.0015 0.0454 0.2347
Echinococcus multilocularis lysosomal alpha glucosidase 0.0179 0.8809 0.8809
Loa Loa (eye worm) hypothetical protein 0.0015 0.0454 0.0516
Loa Loa (eye worm) RNA binding protein 0.007 0.3243 0.3681
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.1723 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.1723 0.1955
Trypanosoma cruzi transcription factor btf3, putative 0.0038 0.1656 0.9476
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0267 0.0271
Brugia malayi RNA recognition motif domain containing protein 0.007 0.3243 0.3681
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0198 0.0198
Brugia malayi hypothetical protein 0.0018 0.0611 0.0694

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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