Detailed information for compound 1644342

Basic information

Technical information
  • TDR Targets ID: 1644342
  • Name: tri(phenyl)-[8-tri(phenyl)phosphaniumyloctyl] phosphanium
  • MW: 636.784 | Formula: C44H46P2++
  • H donors: 0 H acceptors: 0 LogP: 11.53 Rotable bonds: 15
    Rule of 5 violations (Lipinski): 2
  • SMILES: C(CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
  • InChi: 1S/C44H46P2/c1(3-23-37-45(39-25-11-5-12-26-39,40-27-13-6-14-28-40)41-29-15-7-16-30-41)2-4-24-38-46(42-31-17-8-18-32-42,43-33-19-9-20-34-43)44-35-21-10-22-36-44/h5-22,25-36H,1-4,23-24,37-38H2/q+2
  • InChiKey: VHZAYKXOYYQGPN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • tri(phenyl)-[8-tri(phenyl)phosphaniumyloctyl]phosphonium
  • NCI60_024621
  • AIDS-158541
  • AIDS158541
  • NSC670162 (IODIDE SALT)
  • Triphenyl(8-(triphenylphosphoranyl)octyl)phosphorane hydroiodide

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 tuberculosis Putative ferredoxin reductase 0.0117 0.0112 0.3345
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0 0.5
Loa Loa (eye worm) glutathione reductase 0.0051 0.0014 0.0014
Schistosoma mansoni cellular tumor antigen P53 0.0055 0.002 0.002
Schistosoma mansoni tar DNA-binding protein 0.0069 0.004 0.004
Schistosoma mansoni tar DNA-binding protein 0.0069 0.004 0.004
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0008 0.0008
Toxoplasma gondii thioredoxin reductase 0.0051 0.0014 0.0014
Loa Loa (eye worm) thioredoxin reductase 0.0051 0.0014 0.0014
Brugia malayi Latrophilin receptor protein 2 0.0053 0.0017 0.0017
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0053 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0053 0.0017 0.0017
Brugia malayi glutathione reductase 0.0051 0.0014 0.0014
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0267 0.0335 1
Toxoplasma gondii Acetyl-coenzyme A transporter, putative 0.6759 1 1
Leishmania major trypanothione reductase 0.0051 0.0014 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0168 0.0188 0.0188
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0008 0.0008
Brugia malayi RNA recognition motif domain containing protein 0.0069 0.004 0.004
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0008 0.0008
Mycobacterium tuberculosis Probable dehydrogenase 0.0117 0.0112 0.3345
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0117 0.0112 0.3345
Loa Loa (eye worm) RNA binding protein 0.0069 0.004 0.004
Trypanosoma cruzi trypanothione reductase, putative 0.0051 0.0014 1
Brugia malayi TAR-binding protein 0.0069 0.004 0.004
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0053 0.0017 0.0017
Echinococcus multilocularis tar DNA binding protein 0.0069 0.004 0.004
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0008 0.0008
Echinococcus granulosus tumor protein p63 0.0379 0.0502 0.0502
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.013 0.0131 0.3926
Schistosoma mansoni tar DNA-binding protein 0.0069 0.004 0.004
Brugia malayi Protein C21B10.09 in chromosome II 0.6759 1 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0117 0.0112 0.3345
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0053 0.0017 0.0017
Plasmodium vivax glutathione reductase, putative 0.0051 0.0014 1
Schistosoma mansoni solute carrier family 33 (acetyl-CoA transporter 0.6759 1 1
Mycobacterium tuberculosis Probable oxidoreductase 0.013 0.0131 0.3926
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0008 0.0008
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0008 0.0008
Mycobacterium ulcerans lipase LipD 0.0042 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0115 0.0109 0.0109
Schistosoma mansoni solute carrier family 33 (acetyl-CoA transporter 0.6759 1 1
Schistosoma mansoni hypothetical protein 0.0053 0.0017 0.0017
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.013 0.0131 1
Plasmodium falciparum acetyl-CoA transporter, putative 0.6759 1 1
Schistosoma mansoni hypothetical protein 0.0053 0.0017 0.0017
Echinococcus granulosus thioredoxin glutathione reductase 0.0051 0.0014 0.0014
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0 0.5
Schistosoma mansoni hypothetical protein 0.0053 0.0017 0.0017
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0069 0.004 0.004
Echinococcus multilocularis tumor protein p63 0.0379 0.0502 0.0502
Schistosoma mansoni hypothetical protein 0.0053 0.0017 0.0017
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0053 0.0017 0.0017
Brugia malayi Thioredoxin reductase 0.0051 0.0014 0.0014
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0 0.5
Schistosoma mansoni hypothetical protein 0.0115 0.0109 0.0109
Onchocerca volvulus 0.0055 0.002 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0168 0.0188 0.0188
Mycobacterium tuberculosis Probable reductase 0.0117 0.0112 0.3345
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0053 0.0017 0.0017
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0051 0.0014 0.0424
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0008 0.0008
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0008 0.0008
Echinococcus multilocularis thioredoxin glutathione reductase 0.0051 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0168 0.0188 0.0188
Trichomonas vaginalis esterase, putative 0.0042 0 0.5
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0117 0.0112 0.3345
Loa Loa (eye worm) TAR-binding protein 0.0069 0.004 0.004
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0055 0.002 0.002
Schistosoma mansoni solute carrier family 33 (acetyl-CoA transporter 0.2513 0.3679 0.3679
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0168 0.0188 0.0188
Echinococcus granulosus microtubule associated protein 2 0.0748 0.1052 0.1052
Echinococcus multilocularis solute carrier family 33 0.6759 1 1
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0053 0.0017 0.0017
Mycobacterium ulcerans beta-lactamase 0.0042 0 0.5
Plasmodium vivax thioredoxin reductase, putative 0.0051 0.0014 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0117 0.0112 0.8522
Brugia malayi latrophilin 2 splice variant baaae 0.0115 0.0109 0.0109
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0 0.5
Schistosoma mansoni microtubule-associated protein tau 0.0748 0.1052 0.1052
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0008 0.0008
Echinococcus multilocularis GPCR, family 2 0.0053 0.0017 0.0017
Trypanosoma brucei trypanothione reductase 0.0051 0.0014 1
Echinococcus granulosus tar DNA binding protein 0.0069 0.004 0.004
Brugia malayi RNA binding protein 0.0069 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.6759 1 1
Schistosoma mansoni tar DNA-binding protein 0.0069 0.004 0.004
Schistosoma mansoni tar DNA-binding protein 0.0069 0.004 0.004
Echinococcus multilocularis microtubule associated protein 2 0.0748 0.1052 0.1052
Echinococcus granulosus solute carrier family 33 0.6759 1 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.013 0.0131 0.3926
Mycobacterium ulcerans hypothetical protein 0.0042 0 0.5
Echinococcus granulosus GPCR family 2 0.0053 0.0017 0.0017

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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