Detailed information for compound 1642828

Basic information

Technical information
  • TDR Targets ID: 1642828
  • Name: 5-[2-amino-5-(4-chlorophenyl)-3-methylimidazo l-4-yl]disulfanyl-4-(4-chlorophenyl)-1-methyl imidazol-2-amine
  • MW: 477.433 | Formula: C20H18Cl2N6S2
  • H donors: 2 H acceptors: 2 LogP: 4.76 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)c1nc(n(c1SSc1c(nc(n1C)N)c1ccc(cc1)Cl)C)N
  • InChi: 1S/C20H18Cl2N6S2/c1-27-17(15(25-19(27)23)11-3-7-13(21)8-4-11)29-30-18-16(26-20(24)28(18)2)12-5-9-14(22)10-6-12/h3-10H,1-2H3,(H2,23,25)(H2,24,26)
  • InChiKey: BJUAZZBZQITOLC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-[2-amino-5-(4-chlorophenyl)-3-methyl-imidazol-4-yl]disulfanyl-4-(4-chlorophenyl)-1-methyl-imidazol-2-amine
  • 5-[[2-amino-5-(4-chlorophenyl)-3-methyl-4-imidazolyl]disulfanyl]-4-(4-chlorophenyl)-1-methyl-2-imidazolamine
  • [5-[2-amino-5-(4-chlorophenyl)-3-methyl-imidazol-4-yl]disulfanyl-4-(4-chlorophenyl)-1-methyl-imidazol-2-yl]amine
  • 2H-Imidazol-2-imine, 4,4'-dithiobis[5-(4-chlorophenyl)-1,3-dihydro-3-methyl-
  • AIDS-158011
  • AIDS158011
  • NCI60_020685
  • NSC658830 (HYDROCHLORIDE SALT)

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 poly (adp ribose) polymerase 2 0.092 0.4266 0.4471
Trypanosoma brucei poly(adp-ribose) polymerase 0.092 0.4266 0.5
Echinococcus multilocularis 0.0733 0.2956 0.3098
Entamoeba histolytica poly(ADP-ribose) polymerase, putative 0.1675 0.9542 0.5
Loa Loa (eye worm) STE/STE20/MSN protein kinase 0.0733 0.2956 0.4383
Echinococcus multilocularis poly (ADP ribose) polymerase 0.0384 0.052 0.0545
Schistosoma mansoni protein kinase 0.1039 0.5097 0.5341
Loa Loa (eye worm) poly(ADP-ribose) polymerase 0.066 0.2448 0.3628
Brugia malayi probable protein kinase 0.1039 0.5097 0.5341
Echinococcus granulosus WGR domain containing protein 0.052 0.147 0.1541
Echinococcus granulosus poly ADP ribose polymerase 1 0.1675 0.9542 1
Echinococcus granulosus protein kinase 0.0733 0.2956 0.3098
Loa Loa (eye worm) hypothetical protein 0.1275 0.6746 1
Schistosoma mansoni protein kinase 0.0733 0.2956 0.3098
Echinococcus granulosus poly adp ribose polymerase 2 0.092 0.4266 0.4471
Echinococcus granulosus poly (ADP ribose) polymerase 0.052 0.147 0.1541
Brugia malayi WGR domain containing protein 0.1675 0.9542 1
Schistosoma mansoni poly [ADP-ribose] polymerase 0.092 0.4266 0.4471
Brugia malayi WGR domain containing protein 0.092 0.4266 0.4471
Echinococcus multilocularis poly (ADP ribose) polymerase 1 0.1675 0.9542 1
Schistosoma mansoni poly [ADP-ribose] polymerase 0.1675 0.9542 1
Loa Loa (eye worm) hypothetical protein 0.1036 0.507 0.7516
Loa Loa (eye worm) hypothetical protein 0.092 0.4266 0.6324
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.092 0.4266 0.5
Echinococcus granulosus serine:threonine protein kinase mig 15 0.1036 0.507 0.5314
Trypanosoma cruzi poly(ADP-ribose) polymerase, putative 0.092 0.4266 0.5
Schistosoma mansoni poly [ADP-ribose] polymerase 0.0796 0.3398 0.3561

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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