Detailed information for compound 983015

Basic information

Technical information
  • TDR Targets ID: 983015
  • Name: 3,4-dichloro-N-[4-(2-phenylethylsulfamoyl)phe nyl]benzamide
  • MW: 449.35 | Formula: C21H18Cl2N2O3S
  • H donors: 2 H acceptors: 3 LogP: 4.93 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)S(=O)(=O)NCCc1ccccc1
  • InChi: 1S/C21H18Cl2N2O3S/c22-19-11-6-16(14-20(19)23)21(26)25-17-7-9-18(10-8-17)29(27,28)24-13-12-15-4-2-1-3-5-15/h1-11,14,24H,12-13H2,(H,25,26)
  • InChiKey: QLSPOFGIYOANEW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens protein arginine methyltransferase 8 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica arginine N-methyltransferase protein, putative Get druggable targets OG5_127422 All targets in OG5_127422
Brugia malayi hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma congolense arginine N-methyltransferase Get druggable targets OG5_127422 All targets in OG5_127422
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Schistosoma japonicum ko:K00599 prmt1; protein arginine methyltransferase 1 [EC:2.1.1.-], putative Get druggable targets OG5_127422 All targets in OG5_127422
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma congolense arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Echinococcus multilocularis protein arginine methyltransferase Get druggable targets OG5_127422 All targets in OG5_127422
Schistosoma mansoni protein arginine N-methyltransferase 1 Get druggable targets OG5_127422 All targets in OG5_127422
Leishmania donovani arginine N-methyltransferase-like protein Get druggable targets OG5_127422 All targets in OG5_127422
Candida albicans hnRNP methyltransferase. Get druggable targets OG5_127422 All targets in OG5_127422
Echinococcus granulosus protein arginine N methyltransferase 8 Get druggable targets OG5_127422 All targets in OG5_127422
Trichomonas vaginalis protein arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium berghei protein arginine N-methyltransferase 1, putative Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium yoelii probable protein arginine n-methyltransferase Get druggable targets OG5_127422 All targets in OG5_127422
Candida albicans hnRNP methyltransferase. Get druggable targets OG5_127422 All targets in OG5_127422
Babesia bovis conserved hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium falciparum protein arginine N-methyltransferase 1 Get druggable targets OG5_127422 All targets in OG5_127422
Neospora caninum hypothetical protein Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma brucei Protein arginine N-methyltransferase 1 catalytic subunit Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma cruzi arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Echinococcus granulosus protein arginine methyltransferase Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma brucei gambiense arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Leishmania major arginine N-methyltransferase-like protein Get druggable targets OG5_127422 All targets in OG5_127422
Trypanosoma cruzi arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Trichomonas vaginalis protein arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Theileria parva arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Cryptosporidium parvum arginine n-methyltransferase Get druggable targets OG5_127422 All targets in OG5_127422
Trichomonas vaginalis protein arginine N-methyltransferase, putative Get druggable targets OG5_127422 All targets in OG5_127422
Leishmania mexicana arginine N-methyltransferase-like protein Get druggable targets OG5_127422 All targets in OG5_127422
Leishmania infantum arginine N-methyltransferase-like protein Get druggable targets OG5_127422 All targets in OG5_127422
Cryptosporidium hominis ARF GAP-like zinc finger-containing protein (ZIGA2) Get druggable targets OG5_127422 All targets in OG5_127422
Schistosoma mansoni protein arginine N-methyltransferase 1 Get druggable targets OG5_127422 All targets in OG5_127422
Echinococcus multilocularis protein arginine N methyltransferase 8 Get druggable targets OG5_127422 All targets in OG5_127422
Schistosoma mansoni protein arginine N-methyltransferase 1 Get druggable targets OG5_127422 All targets in OG5_127422
Toxoplasma gondii histone arginine methyltransferase PRMT1 Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium vivax protein arginine N-methyltransferase 1, putative Get druggable targets OG5_127422 All targets in OG5_127422
Leishmania braziliensis arginine N-methyltransferase-like protein Get druggable targets OG5_127422 All targets in OG5_127422
Plasmodium knowlesi protein arginine N-methyltransferase 1, putative Get druggable targets OG5_127422 All targets in OG5_127422
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii histone arginine methyltransferase PRMT4/CARM1 protein arginine methyltransferase 8 385 aa 345 aa 33.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.0058 0 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0204 1 1
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.0204 1 0.5
Trypanosoma brucei DNA repair and recombination helicase protein PIF7 0.0204 1 1
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.0204 1 1
Loa Loa (eye worm) hypothetical protein 0.0058 0 0.5
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.0204 1 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0204 1 0.5
Schistosoma mansoni hypothetical protein 0.0204 1 0.5
Giardia lamblia Rrm3p helicase 0.0204 1 0.5
Trypanosoma brucei DNA repair and recombination helicase protein PIF6 0.0204 1 1
Echinococcus multilocularis ATP dependent DNA helicase PIF1 0.0204 1 0.5
Entamoeba histolytica DNA repair and recombination protein, putative 0.0204 1 1
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.0204 1 1
Trypanosoma cruzi DNA repair and recombination helicase protein PIF6, putative 0.0204 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 10.2 uM Inhibition of human recombinant PRMT1-mediated arginine methylation using nonhistone protein Npl3 substrate by ELISA ChEMBL. 21440447
Inhibition (binding) = 37 % Inhibition of methyl transferase activity of SET7/9 at 50 uM using biotinylated histone H3(1-21) substrate by In-vitro time resolved fluorescence immunosorbent methyltransferase assay ChEMBL. 21440447

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

1 literature reference was collected for this gene.

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