Detailed information for compound 576112

Basic information

Technical information
  • TDR Targets ID: 576112
  • Name: disodium 3,10-dianilino-6,13-dichloro-[1,4]be nzoxazino[2,3-b]phenoxazine-2,9-disulfonate
  • MW: 743.501 | Formula: C30H18Cl2N4Na2O8S2
  • H donors: 2 H acceptors: 8 LogP: 6.29 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1c2=Nc3cc(c(cc3Oc2c(c2=Nc3c(Oc12)cc(Nc1ccccc1)c(c3)S(=O)(=O)[O-])Cl)Nc1ccccc1)S(=O)(=O)[O-].[NaH+].[NaH+]
  • InChi: 1S/C30H18Cl2N4O8S2.2Na/c31-25-28-30(44-22-12-20(34-16-9-5-2-6-10-16)24(46(40,41)42)14-18(22)36-28)26(32)27-29(25)43-21-11-19(33-15-7-3-1-4-8-15)23(45(37,38)39)13-17(21)35-27;;/h1-14,33-34H,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2
  • InChiKey: LGEZEBMVCAZZPP-UHFFFAOYSA-L  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • disodium 6,13-dichloro-3,10-bis(phenylazanyl)-[1,4]benzoxazino[2,3-b]phenoxazine-2,9-disulfonate
  • Sirius Supra Blue FGL-CF stain
  • 273213-01-7
  • 6527-70-4
  • 2,9-Triphenodioxazinedisulfonic acid, 6,13-dichloro-3,10-bis(phenylamino)-, disodium salt
  • C.I. Direct Blue 106
  • Disodium 6,13-dichloro-3,10-bis(phenylamino)triphenodioxazine-2,9-disulphonate
  • EINECS 229-417-8
  • Solophenyl Brilliant Blue BL

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
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0717 0.0767
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0188 0.5241 0.5224
Echinococcus multilocularis neutral alpha glucosidase AB 0.0037 0.025 0.0213
Schistosoma mansoni hypothetical protein 0.0333 1 1
Entamoeba histolytica CAAX prenyl protease family 0.0188 0.5241 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0167 0.4551 0.4531
Leishmania major alpha glucosidase II subunit, putative 0.0037 0.025 0.0243
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.308 0.3436
Loa Loa (eye worm) hypothetical protein 0.0299 0.8892 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0167 0.4551 0.4551
Onchocerca volvulus 0.0097 0.222 0.3103
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.025 0.0243
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.025 0.0101
Schistosoma mansoni survival motor neuron protein 0.005 0.066 0.0625
Plasmodium vivax hypothetical protein, conserved 0.0035 0.018 0.5308
Toxoplasma gondii Erv1 / Alr family protein 0.0033 0.0125 0.3276
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.018 0.0161
Brugia malayi Muscleblind-like protein 0.0299 0.8892 1
Loa Loa (eye worm) fli-1 protein 0.0226 0.6494 0.7291
Echinococcus multilocularis muscleblind protein 0.0299 0.8892 0.8888
Echinococcus multilocularis geminin 0.0333 1 1
Echinococcus granulosus muscleblind protein 0.0299 0.8892 0.8892
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0717 0.0767
Loa Loa (eye worm) beta-lactamase 0.0035 0.018 0.0161
Toxoplasma gondii ABC1 family protein 0.0035 0.018 0.5308
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0075 0.1484 0.1633
Loa Loa (eye worm) hypothetical protein 0.0188 0.5241 0.5877
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.025 0.0101
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.0033 0.0125 0.3276
Trichomonas vaginalis set domain proteins, putative 0.0244 0.7072 1
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0188 0.5241 0.5224
Schistosoma mansoni ets-related 0.0226 0.6494 0.6481
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.025 0.024
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0214 0.6095 0.6841
Schistosoma mansoni gabp alpha 0.0075 0.1484 0.1452
Mycobacterium tuberculosis Probable integral membrane protein 0.0039 0.0306 0.0202
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0033 0.0125 0.0125
Brugia malayi DnaJ domain containing protein 0.006 0.0992 0.1078
Schistosoma mansoni hypothetical protein 0.0333 1 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0167 0.4551 0.5098
Mycobacterium ulcerans hypothetical protein 0.0039 0.0306 1
Brugia malayi Pre-SET motif family protein 0.0214 0.6095 0.6841
Brugia malayi MH2 domain containing protein 0.0123 0.308 0.3436
Echinococcus multilocularis CAAX prenyl protease 2 0.0188 0.5241 0.5224
Schistosoma mansoni hypothetical protein 0.005 0.066 0.0625
Brugia malayi CAAX amino terminal protease family protein 0.0188 0.5241 0.5877
Brugia malayi Ets-domain containing protein 0.0075 0.1484 0.1633
Entamoeba histolytica CAAX amino terminal protease family 0.0039 0.0306 0.0113
Echinococcus multilocularis GA binding protein alpha chain 0.0075 0.1484 0.1452
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0224 0.6415 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.018 0.018
Onchocerca volvulus 0.005 0.066 0.0885
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.066 0.0703
Loa Loa (eye worm) hypothetical protein 0.0051 0.0717 0.0767
Schistosoma mansoni hypothetical protein 0.006 0.0992 0.0958
Brugia malayi Augmenter of liver regeneration 0.0033 0.0125 0.0099
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Loa Loa (eye worm) hypothetical protein 0.0299 0.8892 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0037 0.0037
Brugia malayi beta-lactamase family protein 0.0035 0.018 0.0161
Schistosoma mansoni hypothetical protein 0.0035 0.0181 0.0144
Leishmania major CAAX prenyl protease 2, putative,peptidase with unknown catalytic mechanism (family U48) 0.0188 0.5241 1
Mycobacterium tuberculosis Probable conserved integral membrane protein 0.0039 0.0306 0.0202
Plasmodium vivax protease, putative 0.0039 0.0306 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.018 0.0143
Loa Loa (eye worm) hypothetical protein 0.0035 0.0181 0.0162
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.308 0.3436
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.025 0.0101
Plasmodium falciparum protease, putative 0.0039 0.0306 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Brugia malayi beta-lactamase family protein 0.0035 0.018 0.0161
Trypanosoma cruzi peptidase with unknown catalytic mechanism (family U48) 0.0188 0.5241 1
Schistosoma mansoni alpha glucosidase 0.0037 0.025 0.0213
Entamoeba histolytica CAAX amino terminal protease family 0.0039 0.0306 0.0113
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0033 0.0125 0.0088
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Toxoplasma gondii hypothetical protein 0.0039 0.0306 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.018 0.0107
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.025 0.0243
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0167 0.4551 0.5098
Onchocerca volvulus 0.0035 0.018 0.0203
Brugia malayi Ets-domain containing protein 0.0075 0.1484 0.1633
Echinococcus multilocularis survival motor neuron protein 1 0.0243 0.7047 0.7036
Loa Loa (eye worm) hepatopoietin HPO2 0.0033 0.0125 0.0099
Leishmania major hypothetical protein, conserved 0.0035 0.018 0.0107
Trichomonas vaginalis Clan U, family U48, CaaX prenyl peptidase 2-like 0.0188 0.5241 0.7344
Loa Loa (eye worm) DnaJ domain-containing protein 0.006 0.0992 0.1078
Mycobacterium ulcerans hypothetical protein 0.0039 0.0306 1
Echinococcus granulosus CAAX prenyl protease 2 0.0188 0.5241 0.5241
Toxoplasma gondii hypothetical protein 0.0039 0.0306 1
Toxoplasma gondii Erv1 / Alr family protein 0.0033 0.0125 0.3276
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.018 0.0107
Chlamydia trachomatis hypothetical protein 0.0039 0.0306 0.5
Echinococcus multilocularis dnaJ subfamily C 6 0.006 0.0992 0.0958
Echinococcus granulosus GA binding protein alpha chain 0.0075 0.1484 0.1484
Brugia malayi Fli-1 protein 0.0226 0.6494 0.7291
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.025 0.0101
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.025 0.0101
Echinococcus multilocularis muscleblind protein 1 0.0299 0.8892 0.8888
Loa Loa (eye worm) hypothetical protein 0.0064 0.1127 0.123
Toxoplasma gondii CAAX amino terminal protease family protein 0.0039 0.0306 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0181 0.0162
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.025 0.0101
Mycobacterium ulcerans integral membrane protein 0.0039 0.0306 1
Schistosoma mansoni alpha-glucosidase 0.0144 0.3781 0.3758
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.018 0.0143
Echinococcus multilocularis lysosomal alpha glucosidase 0.0167 0.4551 0.4531
Brugia malayi Glycosyl hydrolases family 31 protein 0.0037 0.025 0.024
Echinococcus granulosus dnaJ subfamily C 6 0.006 0.0992 0.0992
Giardia lamblia Hypothetical protein 0.0188 0.5241 0.5
Mycobacterium tuberculosis Probable conserved integral membrane protein 0.0039 0.0306 0.0202
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.018 0.0161
Mycobacterium leprae Probable lipase LipE 0.0035 0.018 0.5
Onchocerca volvulus 0.0244 0.7072 1
Brugia malayi beta-lactamase 0.0035 0.018 0.0161
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.018 0.0143
Mycobacterium leprae conserved hypothetical protein 0.0035 0.018 0.5
Loa Loa (eye worm) hypothetical protein 0.0243 0.7047 0.7916
Echinococcus granulosus neutral alpha glucosidase AB 0.0037 0.025 0.025
Schistosoma mansoni alpha-glucosidase 0.0144 0.3781 0.3758
Onchocerca volvulus 0.0035 0.018 0.0203
Trypanosoma brucei glucosidase, putative 0.0037 0.025 0.0243
Mycobacterium tuberculosis Conserved hypothetical protein 0.0039 0.0306 0.0202
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.025 0.79
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.025 0.0101
Brugia malayi hypothetical protein 0.0243 0.7047 0.7916
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0717 0.0767
Onchocerca volvulus 0.0035 0.018 0.0203
Trypanosoma cruzi CAAX prenyl protease 2, putative 0.0188 0.5241 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.025 0.0101
Echinococcus granulosus survival motor neuron protein 1 0.0243 0.7047 0.7047
Trypanosoma brucei CAAX amino terminal protease, putative 0.0188 0.5241 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.018 0.0161
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.025 0.0101
Treponema pallidum hypothetical protein 0.0039 0.0306 0.5
Trichomonas vaginalis protein kinase inhibitor, putative 0.006 0.0992 0.1177
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.018 0.0107

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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