Detailed information for compound 907412

Basic information

Technical information
  • TDR Targets ID: 907412
  • Name: ethyl (2E)-7-methyl-3-oxo-5-phenyl-2-[(4-prop -2-enoxyphenyl)methylidene]-5H-[1,3]thiazolo[ 3,2-a]pyrimidine-6-carboxylate
  • MW: 460.545 | Formula: C26H24N2O4S
  • H donors: 0 H acceptors: 2 LogP: 5.08 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=CCOc1ccc(cc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)OCC)C
  • InChi: 1S/C26H24N2O4S/c1-4-15-32-20-13-11-18(12-14-20)16-21-24(29)28-23(19-9-7-6-8-10-19)22(25(30)31-5-2)17(3)27-26(28)33-21/h4,6-14,16,23H,1,5,15H2,2-3H3/b21-16+
  • InChiKey: BKJVLZYRJLLFER-LTGZKZEYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ethyl (2E)-2-[(4-allyloxyphenyl)methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
  • (2E)-2-[(4-allyloxyphenyl)methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
  • (2E)-2-(4-allyloxybenzylidene)-3-keto-7-methyl-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
  • AG-690/12071126

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 bromodomain adjacent to zinc finger domain 0.0058 0.4571 0.6844
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.1004 0.0283
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.3639 0.5449
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 0.5
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 0.5
Loa Loa (eye worm) hypothetical protein 0.0038 0.2141 0.2045
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.164 0.1538
Loa Loa (eye worm) hypothetical protein 0.0033 0.164 0.1538
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.3609 0.5
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.1863 0.279
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.3609 0.5
Schistosoma mansoni hypothetical protein 0.002 0.012 0.018
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0105 1 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 0.6679 1
Schistosoma mansoni hypothetical protein 0.0033 0.164 0.2455
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.3639 0.5449
Brugia malayi Probable ClpP-like protease 0.0076 0.6679 0.6464
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.3609 0.5404
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.1004 0.0283
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.1004 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.164 0.2455
Loa Loa (eye worm) hypothetical protein 0.004 0.2411 0.2318
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.4571 0.6844
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 0.6679 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.164 0.2455
Echinococcus granulosus peptidase Clp S14 family 0.005 0.3609 0.5404
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.6679 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.3609 0.4744
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0338 0.0506
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.3639 0.5449
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 0.6679 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.1004 0.0283
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 0.5
Echinococcus granulosus GPCR family 2 0.0033 0.164 0.2455
Schistosoma mansoni hypothetical protein 0.0033 0.164 0.2455
Loa Loa (eye worm) hypothetical protein 0.0069 0.5826 0.5776
Brugia malayi Bromodomain containing protein 0.0073 0.6314 0.6075
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0338 0.0506
Schistosoma mansoni hypothetical protein 0.0072 0.613 0.9179
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.3639 0.5449
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 0.6679 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.1863 0.279
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.3639 0.5449
Loa Loa (eye worm) hypothetical protein 0.0076 0.6679 0.6638
Brugia malayi Latrophilin receptor protein 2 0.0033 0.164 0.1099
Brugia malayi Bromodomain containing protein 0.0037 0.2133 0.1624
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0338 0.0506
Schistosoma mansoni bromodomain containing protein 0.0062 0.4979 0.7455
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.613 0.588
Brugia malayi Calcitonin receptor-like protein seb-1 0.0105 1 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 0.5
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 0.5
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.1004 0.5
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.164 0.1099
Brugia malayi hypothetical protein 0.0028 0.1004 0.0422
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.164 0.2455
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.005 0.3639 0.3562
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.3639 0.5449
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 0.6679 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.3639 0.5449
Loa Loa (eye worm) hypothetical protein 0.0028 0.1004 0.0895
Loa Loa (eye worm) hypothetical protein 0.0042 0.2628 0.2538
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.164 0.2455
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 0.6679 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.1004 0.0283
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.1004 0.5
Schistosoma mansoni hypothetical protein 0.0033 0.164 0.2455
Loa Loa (eye worm) hypothetical protein 0.0105 1 1
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.6679 1
Echinococcus multilocularis GPCR, family 2 0.0033 0.164 0.2455
Leishmania major hypothetical protein, conserved 0.0028 0.1004 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.005 0.3639 0.3228
Schistosoma mansoni hypothetical protein 0.0033 0.164 0.2455
Loa Loa (eye worm) hypothetical protein 0.0072 0.613 0.6083

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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