Detailed information for compound 589684

Basic information

Technical information
  • TDR Targets ID: 589684
  • Name: azanide; cyclohexanamine; platinum(2+); citra te
  • MW: 1119.92 | Formula: C24H50N6O7Pt3
  • H donors: 7 H acceptors: 7 LogP: -5.81 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 3
  • SMILES: [O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.NC1CCCCC1.NC1CCCCC1.NC1CCCCC1.[Pt+2].[Pt+2].[Pt+2].[NH2-].[NH2-].[NH2-]
  • InChi: 1S/3C6H13N.C6H8O7.3H2N.3Pt/c3*7-6-4-2-1-3-5-6;7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;/h3*6H,1-5,7H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);3*1H2;;;/q;;;;3*-1;3*+2/p-3
  • InChiKey: VFYPNZXFSRVERS-UHFFFAOYSA-K  


Substructure search Similarity search

Network

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Synonyms

  • azanide; cyclohexanamine; 2-hydroxypropane-1,2,3-tricarboxylate; platinum(2+)
  • azanide; cyclohexylamine; platinum(2+); citrate
  • 1,2-diaminocyclohexaneplatinum II citrate
  • azanide; cyclohexanamine; 2-hydroxypropane-1,2,3-tricarboxylate; platinum(+2) cation
  • azanide; cyclohexanamine; platinum(+2) cation; citrate
  • azanide; cyclohexylamine; platinum(+2) cation; citrate
  • 96081-74-2
  • Dach-Pt(II)citrate
  • Platinex

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
Mycobacterium ulcerans oxidoreductase 0.0031 0.5377 1
Loa Loa (eye worm) intermediate filament protein 0.0027 0.4349 0.4349
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.7061 0.7016
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.5377 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.3368 0.4731
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.5377 0.5092
Echinococcus multilocularis lamin 0.0027 0.4349 0.4263
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0031 0.5377 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0031 0.5377 1
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.1563 0.5
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.3368 0.2416
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Entamoeba histolytica aldose reductase, putative 0.0031 0.5377 0.544
Loa Loa (eye worm) hypothetical protein 0.0024 0.3368 0.3368
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 1 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) oxidoreductase 0.0031 0.5377 0.5377
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 1 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) oxidoreductase 0.0031 0.5377 0.5377
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.4349 0.4001
Entamoeba histolytica hypothetical protein 0.0036 0.7061 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Leishmania major aldo-keto reductase-like protein 0.0031 0.5377 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0031 0.5377 1
Echinococcus multilocularis aldo keto reductase 0.0031 0.5377 0.5307
Echinococcus granulosus aldehyde reductase 0.0022 0.2728 0.2618
Loa Loa (eye worm) oxidoreductase 0.0031 0.5377 0.5377
Loa Loa (eye worm) hypothetical protein 0.0018 0.1563 0.1563
Loa Loa (eye worm) oxidoreductase 0.0031 0.5377 0.5377
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.3368 0.5105
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 1 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Echinococcus multilocularis aldo keto reductase 0.0031 0.5377 0.5307
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.1563 0.1563
Onchocerca volvulus 0.0031 0.5377 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Onchocerca volvulus 0.0031 0.5377 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.7061 0.7016
Echinococcus granulosus lamin 0.0027 0.4349 0.4263
Echinococcus multilocularis musashi 0.0027 0.4349 0.4263
Loa Loa (eye worm) hypothetical protein 0.0024 0.3368 0.3368
Loa Loa (eye worm) hypothetical protein 0.0024 0.3368 0.3368
Mycobacterium tuberculosis Probable oxidoreductase 0.0031 0.5377 1
Entamoeba histolytica hypothetical protein 0.0036 0.7061 1
Onchocerca volvulus 0.0031 0.5377 1
Entamoeba histolytica aldose reductase, putative 0.0031 0.5377 0.544
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Onchocerca volvulus 0.0031 0.5377 1
Echinococcus multilocularis aldo keto reductase 0.0031 0.5377 0.5307
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.3368 0.4731
Mycobacterium ulcerans hypothetical protein 0.0024 0.3368 0.4731
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Entamoeba histolytica hypothetical protein 0.0036 0.7061 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.3368 0.4731
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.7061 0.4799
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 1 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.5377 0.5092
Trypanosoma cruzi aldo-keto reductase 0.0031 0.5377 0.5
Echinococcus granulosus hypothetical protein 0.0031 0.5377 0.5307
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.4349 0.4349
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.1563 0.1563
Echinococcus granulosus aldo keto reductase 0.0031 0.5377 0.5307
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.1563 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Echinococcus granulosus aldo keto reductase 0.0031 0.5377 0.5307
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) hypothetical protein 0.0013 0.0149 0.0149
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.3368 0.4731
Schistosoma mansoni aldo-keto reductase 0.0031 0.5377 0.1819
Loa Loa (eye worm) hypothetical protein 0.0018 0.1563 0.1563
Giardia lamblia Aldose reductase 0.0031 0.5377 0.5
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 1 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.5377 0.5092
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Brugia malayi intermediate filament protein 0.0027 0.4349 0.4001
Loa Loa (eye worm) hypothetical protein 0.0027 0.42 0.42
Entamoeba histolytica aldose reductase, putative 0.0031 0.5377 0.544
Brugia malayi AMP-binding enzyme family protein 0.0024 0.3368 0.296
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.1563 0.071
Trichomonas vaginalis aldo/keto reductase, putative 0.0031 0.5377 0.5
Echinococcus granulosus aldo keto reductase 0.0031 0.5377 0.5307
Loa Loa (eye worm) hypothetical protein 0.0031 0.5377 0.5377
Toxoplasma gondii aldose reductase, putative 0.0031 0.5377 0.5
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.5377 0.5
Brugia malayi hypothetical protein 0.0036 0.7061 0.688
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 1 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.4349 0.4349
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.3368 0.4731
Onchocerca volvulus 0.0031 0.5377 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.3368 0.4731
Schistosoma mansoni aldo-keto reductase 0.0031 0.5377 0.1819
Onchocerca volvulus 0.0031 0.5377 1
Echinococcus granulosus lamin dm0 0.0027 0.4349 0.4263
Echinococcus multilocularis lamin dm0 0.0027 0.4349 0.4263
Schistosoma mansoni pol-related 0.0031 0.5377 0.1819
Trypanosoma cruzi aldo/keto reductase, putative 0.0031 0.5377 0.5
Entamoeba histolytica hypothetical protein 0.0036 0.7061 1
Loa Loa (eye worm) oxidoreductase 0.0031 0.5377 0.5377
Trypanosoma brucei prostaglandin f synthase 0.0031 0.5377 0.5
Leishmania major prostaglandin f synthase, putative 0.0031 0.5377 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.3368 0.2416
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.3368 0.5105
Echinococcus granulosus intermediate filament protein 0.0027 0.4349 0.4263
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Brugia malayi AMP-binding enzyme family protein 0.0024 0.3368 0.296
Trypanosoma brucei aldo-keto reductase, putative 0.0031 0.5377 0.5
Echinococcus multilocularis aldehyde reductase 0.0022 0.2728 0.2618
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.5377 0.5
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0031 0.5377 0.5092
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.3368 0.4731
Schistosoma mansoni hypothetical protein 0.0036 0.7061 0.4799
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0031 0.5377 0.5307
Brugia malayi AMP-binding enzyme family protein 0.0024 0.3368 0.296
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307
Echinococcus multilocularis aldo keto reductase 0.0031 0.5377 0.5307
Giardia lamblia Aldose reductase 0.0031 0.5377 0.5
Onchocerca volvulus 0.0027 0.4349 0.4883
Loa Loa (eye worm) hypothetical protein 0.0018 0.1563 0.1563
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0031 0.5377 0.5
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.058 0.058
Onchocerca volvulus 0.0027 0.4349 0.4883
Trichomonas vaginalis aldo-keto reductase, putative 0.0031 0.5377 0.5
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.1563 0.5
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0031 0.5377 0.5307

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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