Detailed information for compound 588094

Basic information

Technical information
  • TDR Targets ID: 588094
  • Name: 1,2-divinylbenzene; 1-ethyl-2-vinyl-benzene; styrene
  • MW: 366.538 | Formula: C28H30
  • H donors: 0 H acceptors: 0 LogP: 9.67 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=Cc1ccccc1C=C.C=Cc1ccccc1CC.C=Cc1ccccc1
  • InChi: 1S/C10H12.C10H10.C8H8/c2*1-3-9-7-5-6-8-10(9)4-2;1-2-8-6-4-3-5-7-8/h3,5-8H,1,4H2,2H3;3-8H,1-2H2;2-7H,1H2
  • InChiKey: NWUYHJFMYQTDRP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1,2-divinylbenzene; 1-ethyl-2-vinylbenzene; styrene
  • 1,2-bis(ethenyl)benzene; ethenylbenzene; 1-ethenyl-2-ethyl-benzene
  • 1,2-bis(ethenyl)benzene; 1-ethenyl-2-ethylbenzene; styrene
  • porapak P
  • 1,2-di(ethenyl)benzene; 1-ethenyl-2-ethylbenzene; styrene
  • 1,2-di(ethenyl)benzene; ethenylbenzene; 1-ethenyl-2-ethyl-benzene
  • 11129-91-2
  • 9052-95-3
  • 9058-23-5
  • 69011-20-7
  • 68584-06-5
  • Benzene, diethenyl-, polymer with ethenylbenzene and ethenylethylbenzene, sulfonated, lithium salt
  • Benzene, diethenyl-, polymer with ethenylbenzene and ethenylethylbenzene, sulfonated, lithium salts
  • Ethenylbenzene, ethylethenylbenzene, diethenylbenzene polymer, sulfonated, lithium salt
  • Benzene, diethenyl-, polymer with ethenylbenzene and ethenylethylbenzene, sulfonated
  • Ethylbenzene, ethylethenylbenzene, diethenylbenzene polymer, sulfonated
  • Benzene, diethenyl-, polymer with ethenylbenzene and ethenylethylbenzene
  • Divinylbenzene, ethylvinylbenzene, vinylbenzene copolymer
  • Ethenylbenzene, diethenylbenzene, ethylethenylbenzene polymer

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
Schistosoma mansoni ferritin 0.0028 0.0067 0.002
Brugia malayi beta-lactamase family protein 0.0118 0.1295 0.4052
Schistosoma mansoni zinc finger protein 0.0051 0.0378 0.0463
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0563 0.0726
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0057 0.0458 0.3416
Schistosoma mansoni hypothetical protein 0.0309 0.3911 0.5479
Mycobacterium leprae conserved hypothetical protein 0.0118 0.1295 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0118 0.1295 1
Echinococcus multilocularis GPCR, family 2 0.0032 0.0123 0.01
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0123 0.0313
Schistosoma mansoni hypothetical protein 0.0541 0.7096 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Mycobacterium ulcerans hypothetical protein 0.0118 0.1295 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0118 0.1295 0.1764
Toxoplasma gondii FATC domain-containing protein 0.0027 0.0052 0.0218
Mycobacterium tuberculosis Conserved protein 0.0118 0.1295 0.1237
Loa Loa (eye worm) bromodomain containing protein 0.0063 0.0542 0.1864
Schistosoma mansoni ferritin light chain 0.0028 0.0067 0.002
Mycobacterium tuberculosis Conserved protein 0.0118 0.1295 0.1237
Echinococcus granulosus histone acetyltransferase KAT2B 0.0162 0.1897 0.2619
Loa Loa (eye worm) hypothetical protein 0.0058 0.0472 0.1623
Onchocerca volvulus 0.0118 0.1295 1
Schistosoma mansoni ferritin 0.0028 0.0067 0.002
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0203 0.2461 0.342
Schistosoma mansoni ferritin light chain 0.0028 0.0067 0.002
Loa Loa (eye worm) hypothetical protein 0.0025 0.0024 0.0084
Loa Loa (eye worm) hypothetical protein 0.0146 0.1683 0.5785
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0118 0.1295 0.4452
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0123 0.0421
Echinococcus granulosus histone acetyltransferase KAT2B 0.0057 0.0458 0.0577
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0027 0.0052 0.0403
Loa Loa (eye worm) hypothetical protein 0.007 0.0637 0.2189
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.0472 0.0596
Brugia malayi beta-lactamase 0.0118 0.1295 0.4052
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0563 0.0726
Mycobacterium tuberculosis Probable hydrolase 0.0118 0.1295 0.1237
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.0376 0.0459
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0028 0.0067 0.5
Mycobacterium leprae Probable lipase LipE 0.0118 0.1295 1
Brugia malayi beta-lactamase family protein 0.0118 0.1295 0.4052
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0563 0.0726
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.0458 0.0576
Treponema pallidum bacterioferrin (TpF1) 0.0028 0.0067 0.5
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0057 0.0458 0.3416
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Brugia malayi acetyltransferase, GNAT family protein 0.0174 0.2069 0.652
Mycobacterium tuberculosis Probable lipase LipD 0.0118 0.1295 0.1237
Trichomonas vaginalis esterase, putative 0.0118 0.1295 1
Echinococcus granulosus tar DNA binding protein 0.0064 0.0563 0.0726
Echinococcus multilocularis beta LACTamase domain containing family member 0.0118 0.1295 0.1764
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0118 0.1295 1
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0376 0.0459
Leishmania major hypothetical protein, conserved 0.0051 0.0378 0.2783
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.012 0.132 0.18
Schistosoma mansoni hypothetical protein 0.0541 0.7096 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Trichomonas vaginalis ferritin, putative 0.0028 0.0067 0.0116
Loa Loa (eye worm) hypothetical protein 0.014 0.1596 0.5485
Echinococcus granulosus endonuclease exonuclease phosphatase 0.02 0.2423 0.3365
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.0458 0.0576
Schistosoma mansoni apoferritin-2 0.0028 0.0067 0.002
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0174 0.2069 0.2863
Schistosoma mansoni apoferritin-2 0.0028 0.0067 0.002
Schistosoma mansoni bromodomain containing protein 0.0215 0.2625 0.3652
Schistosoma mansoni hypothetical protein 0.0032 0.0123 0.01
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0102 0.108 0.3711
Leishmania major hypothetical protein, conserved 0.0118 0.1295 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.0472 0.0596
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0102 0.108 0.3365
Schistosoma mansoni zinc finger protein 0.0069 0.0629 0.0819
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1295 1
Brugia malayi RNA binding protein 0.0064 0.0563 0.1719
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.0376 0.0459
Trypanosoma cruzi ISWI complex protein 0.0051 0.0378 0.292
Brugia malayi Bromodomain containing protein 0.0132 0.1484 0.4655
Loa Loa (eye worm) PHD-finger family protein 0.0069 0.0622 0.2137
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Brugia malayi latrophilin 2 splice variant baaae 0.007 0.0637 0.1952
Echinococcus granulosus expressed protein 0.0028 0.0067 0.002
Onchocerca volvulus 0.0118 0.1295 1
Trypanosoma brucei ISWI complex protein 0.0051 0.0378 0.2783
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0024 0.0189
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0123 0.01
Echinococcus granulosus GPCR family 2 0.0032 0.0123 0.01
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1295 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.012 0.132 0.18
Schistosoma mansoni hypothetical protein 0.0051 0.0378 0.0463
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0123 0.01
Schistosoma mansoni methyl-cpg binding protein mbd 0.0057 0.0458 0.0576
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0024 0.0189
Echinococcus multilocularis geminin 0.0541 0.7096 1
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0563 0.1719
Brugia malayi Bromodomain containing protein 0.0254 0.316 1
Onchocerca volvulus 0.0118 0.1295 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0118 0.1295 0.1764
Schistosoma mansoni ferritin 0.0028 0.0067 0.002
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.0376 0.1291
Mycobacterium ulcerans beta-lactamase 0.0118 0.1295 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0563 0.0726
Trypanosoma cruzi hypothetical protein, conserved 0.0118 0.1295 1
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0027 0.0052 0.0218
Loa Loa (eye worm) acetyltransferase 0.0174 0.2069 0.7112
Schistosoma mansoni methyl-cpg binding protein mbd 0.0057 0.0458 0.0576
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0458 0.0576
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0563 0.0726
Loa Loa (eye worm) RNA binding protein 0.0064 0.0563 0.1937
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.0472 0.0596
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0057 0.0458 0.3416
Loa Loa (eye worm) hypothetical protein 0.0032 0.0123 0.0421
Brugia malayi mbt repeat family protein 0.0051 0.0376 0.112
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Echinococcus multilocularis zinc finger protein 0.0069 0.0629 0.0819
Loa Loa (eye worm) beta-lactamase 0.0118 0.1295 0.4452
Brugia malayi Calcitonin receptor-like protein seb-1 0.0102 0.108 0.3365
Trichomonas vaginalis penicillin-binding protein, putative 0.0118 0.1295 1
Echinococcus granulosus geminin 0.0541 0.7096 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.02 0.2423 0.3365
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.0472 0.1427
Loa Loa (eye worm) hypothetical protein 0.0057 0.0458 0.1575
Echinococcus granulosus ferritin 0.0028 0.0067 0.002
Schistosoma mansoni hypothetical protein 0.0032 0.0123 0.01
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0118 0.1295 0.1237
Brugia malayi mbt repeat family protein 0.0051 0.0376 0.112
Schistosoma mansoni hypothetical protein 0.0069 0.0622 0.0808
Mycobacterium ulcerans esterase/lipase LipP 0.0118 0.1295 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0045 0.0294 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0057 0.0458 0.3269
Schistosoma mansoni hypothetical protein 0.007 0.0637 0.083
Trypanosoma cruzi ISWI complex protein 0.0051 0.0378 0.292
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0027 0.0052 0.0088
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0123 0.01
Plasmodium vivax hypothetical protein, conserved 0.0118 0.1295 1
Loa Loa (eye worm) hypothetical protein 0.0236 0.2909 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0563 0.1937
Echinococcus granulosus fetal alzheimer antigen falz 0.0075 0.0709 0.0932
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0123 0.01
Trypanosoma brucei hypothetical protein, conserved 0.0118 0.1295 1
Loa Loa (eye worm) hypothetical protein 0.0102 0.108 0.3711
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0123 0.0313
Loa Loa (eye worm) hypothetical protein 0.0051 0.0376 0.1291
Schistosoma mansoni hypothetical protein 0.0032 0.0123 0.01
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0203 0.2461 0.342
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0563 0.0726
Echinococcus granulosus methyl CpG binding domain protein 2 0.0057 0.0458 0.0576
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0118 0.1295 0.1237
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0118 0.1295 0.1764
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0563 0.1937
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.0376 0.0459
Loa Loa (eye worm) MBCTL1 0.0058 0.0472 0.1623
Loa Loa (eye worm) hypothetical protein 0.0128 0.1432 0.4921
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.0472 0.0596
Giardia lamblia Histone acetyltransferase GCN5 0.0045 0.0294 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1295 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0045 0.0294 1
Mycobacterium tuberculosis Conserved protein 0.0118 0.1295 0.1237
Schistosoma mansoni ferritin 0.0028 0.0067 0.002
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0075 0.0709 0.0932
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.0472 0.0596
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0458 0.0576
Trypanosoma cruzi hypothetical protein, conserved 0.0118 0.1295 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0075 0.0709 0.0932
Mycobacterium tuberculosis Probable lipase LipE 0.0118 0.1295 0.1237
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0174 0.2069 0.2863
Mycobacterium tuberculosis Probable esterase LipL 0.0118 0.1295 0.1237
Echinococcus granulosus zinc finger protein 0.0069 0.0629 0.0819
Brugia malayi TAR-binding protein 0.0064 0.0563 0.1719
Brugia malayi PHD-finger family protein 0.0087 0.0873 0.2706
Trichomonas vaginalis bromodomain-containing protein, putative 0.0057 0.0458 0.3269
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0118 0.1295 0.4052
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0376 0.0459
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0057 0.0458 0.0576
Loa Loa (eye worm) hypothetical protein 0.0118 0.1295 0.4452
Schistosoma mansoni hypothetical protein 0.0032 0.0123 0.01
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.0376 0.0459
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0118 0.1295 0.1237
Echinococcus multilocularis expressed protein 0.0028 0.0067 0.002
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.0376 0.0459
Mycobacterium ulcerans lipase LipD 0.0118 0.1295 1
Toxoplasma gondii ABC1 family protein 0.0118 0.1295 1
Echinococcus multilocularis ferritin 0.0028 0.0067 0.002

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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