Detailed information for compound 702933

Basic information

Technical information
  • TDR Targets ID: 702933
  • Name: 5-[(3-chlorophenyl)-(2,6-dimethylmorpholin-4- yl)methyl]-2-ethyl-[1,3]thiazolo[2,3-e][1,2,4 ]triazol-6-ol
  • MW: 406.93 | Formula: C19H23ClN4O2S
  • H donors: 1 H acceptors: 3 LogP: 4.35 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1nn2c(n1)sc(c2O)C(c1cccc(c1)Cl)N1CC(C)OC(C1)C
  • InChi: 1S/C19H23ClN4O2S/c1-4-15-21-19-24(22-15)18(25)17(27-19)16(13-6-5-7-14(20)8-13)23-9-11(2)26-12(3)10-23/h5-8,11-12,16,25H,4,9-10H2,1-3H3
  • InChiKey: XJSQNSJLASWBQM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5-[(3-chlorophenyl)-(2,6-dimethylmorpholin-4-yl)methyl]-2-ethyl-thiazolo[2,3-e][1,2,4]triazol-6-ol
  • 5-[(3-chlorophenyl)-(2,6-dimethyl-4-morpholinyl)methyl]-2-ethyl-6-thiazolo[2,3-e][1,2,4]triazolol

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
Toxoplasma gondii ABC1 family protein 0.0036 0.0079 0.2845
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.0164 0.5905
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0167 0.0256
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.0313 0.037
Brugia malayi beta-lactamase 0.0036 0.0079 0.0253
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Echinococcus granulosus survival motor neuron protein 1 0.0235 0.2645 0.313
Brugia malayi acetyltransferase, GNAT family protein 0.0144 0.1474 0.4726
Echinococcus granulosus microtubule associated protein 2 0.0686 0.8453 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0079 0.0253
Onchocerca volvulus 0.0036 0.0079 0.0297
Echinococcus multilocularis survival motor neuron protein 1 0.0235 0.2645 0.2645
Brugia malayi hypothetical protein 0.0036 0.0078 0.0252
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.0164 0.0193
Echinococcus granulosus geminin 0.0176 0.1879 0.2223
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1466 0.4028
Entamoeba histolytica acetyltransferase, GNAT family 0.0039 0.0118 1
Brugia malayi hypothetical protein 0.0033 0.0043 0.0139
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.0164 0.0279
Loa Loa (eye worm) hypothetical protein 0.005 0.0262 0.0842
Toxoplasma gondii LsmAD domain-containing protein 0.0051 0.0277 1
Schistosoma mansoni hypothetical protein 0.0048 0.0235 0.0278
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Loa Loa (eye worm) beta-lactamase 0.0036 0.0079 0.0253
Schistosoma mansoni hypothetical protein 0.0036 0.0078 0.0093
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0228 0.027
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0207 0.2282 0.7321
Schistosoma mansoni survival motor neuron protein 0.0048 0.0235 0.0278
Toxoplasma gondii TIM10 family protein, putative 0.0047 0.0229 0.8273
Mycobacterium ulcerans hypothetical protein 0.016 0.1675 0.5252
Giardia lamblia Histone acetyltransferase GCN5 0.0039 0.0118 0.5
Onchocerca volvulus 0.0236 0.2651 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1466 0.4028
Toxoplasma gondii hypothetical protein 0.0049 0.0248 0.8946
Onchocerca volvulus 0.0048 0.0235 0.0888
Schistosoma mansoni microtubule-associated protein tau 0.0686 0.8453 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0167 0.0256
Brugia malayi mbt repeat family protein 0.0047 0.0229 0.0733
Leishmania major hypothetical protein, conserved 0.0051 0.0277 0.0575
Loa Loa (eye worm) transport to inner mitochondrial membrane family member 0.0047 0.0229 0.0735
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.3523 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0144 0.1474 0.1474
Loa Loa (eye worm) hypothetical protein 0.0235 0.2645 0.8485
Schistosoma mansoni glutaminase 0.0272 0.3118 0.3688
Echinococcus multilocularis geminin 0.0176 0.1879 0.1879
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0144 0.1466 0.4028
Brugia malayi beta-lactamase family protein 0.0036 0.0079 0.0253
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.0164 0.5905
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0187 0.2024 0.2395
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0079 0.0093
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0078 0.0093
Schistosoma mansoni hypothetical protein 0.0034 0.0058 0.0069
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0078 0.0078
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0277 0.0575
Mycobacterium leprae Probable lipase LipE 0.0036 0.0079 0.5
Plasmodium vivax ataxin-2 like protein, putative 0.0051 0.0277 1
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.0229 0.0229
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0228 0.0228
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.027
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.0164 0.0279
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.027
Schistosoma mansoni hypothetical protein 0.0176 0.1879 0.2223
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0167 0.0256
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.0229 0.027
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0187 0.2024 0.2024
Trichomonas vaginalis glutaminase, putative 0.0272 0.3118 1
Loa Loa (eye worm) leukotriene A4 hydrolase 0.023 0.2584 0.8287
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0229 0.2563 1
Onchocerca volvulus 0.0047 0.0229 0.0862
Echinococcus granulosus expressed protein 0.0047 0.0229 0.0271
Leishmania major mitochondrial DNA polymerase beta 0.0303 0.3523 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0079 0.0253
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.0313 0.0313
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0277 1
Loa Loa (eye worm) glutaminase 0.0272 0.3118 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.027
Mycobacterium tuberculosis Conserved hypothetical protein 0.016 0.1675 0.6426
Loa Loa (eye worm) acetyltransferase 0.0144 0.1474 0.4726
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0079 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0078 0.0093
Loa Loa (eye worm) hypothetical protein 0.0047 0.0229 0.0733
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0287 0.0605
Brugia malayi hypothetical protein 0.0051 0.0277 0.0888
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.0229 0.027
Plasmodium vivax mitochondrial import inner membrane translocase subunit TIM10, putative 0.0047 0.0229 0.8273
Loa Loa (eye worm) hypothetical protein 0.0034 0.0058 0.0188
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0079 0.2845
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.0229 0.0733
Toxoplasma gondii mitochondrial import inner membrane translocase subunit TIM10, putative 0.0047 0.0229 0.8273
Onchocerca volvulus 0.0036 0.0079 0.0297
Schistosoma mansoni mitochondrial import inner membrane translocase subunit tim10 0.0047 0.0229 0.0271
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0277 0.0575
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0229 0.027
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.0164 0.5905
Loa Loa (eye worm) hypothetical protein 0.0054 0.0313 0.1004
Brugia malayi mbt repeat family protein 0.0047 0.0229 0.0733
Schistosoma mansoni hypothetical protein 0.0288 0.333 0.394
Onchocerca volvulus 0.0036 0.0079 0.0297
Schistosoma mansoni hypothetical protein 0.0176 0.1879 0.2223
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Plasmodium falciparum mitochondrial import inner membrane translocase subunit TIM10, putative 0.0047 0.0229 0.6989
Echinococcus granulosus histone acetyltransferase KAT2B 0.014 0.1421 0.1682
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0262 0.0842
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0229 0.027
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.0229 0.0229
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0228 0.0732
Brugia malayi hypothetical protein 0.0106 0.0981 0.3147
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0262 0.0842
Loa Loa (eye worm) glutaminase 2 0.0272 0.3118 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.0313 0.037
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.3523 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0228 0.0732
Mycobacterium ulcerans glutaminase 0.0272 0.3118 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0079 0.0093
Echinococcus multilocularis leukotriene A 4 hydrolase 0.023 0.2584 0.2584
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0079 0.0079
Echinococcus multilocularis expressed protein 0.0047 0.0229 0.0229
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0167 0.0256
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0047 0.0229 0.0862
Brugia malayi glutaminase DH11.1 0.0272 0.3118 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0144 0.1474 0.1743
Trypanosoma brucei PAB1-binding protein , putative 0.0051 0.0277 0.0575
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0235 0.0755
Brugia malayi Pre-SET motif family protein 0.0207 0.2282 0.7321
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.023 0.2584 0.3056
Brugia malayi beta-lactamase family protein 0.0036 0.0079 0.0253
Loa Loa (eye worm) MBCTL1 0.0054 0.0313 0.1004
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.0313 0.037
Trichomonas vaginalis set domain proteins, putative 0.0236 0.2651 0.8463
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0228 0.027
Loa Loa (eye worm) hypothetical protein 0.0036 0.0079 0.0253
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0313 0.1004
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0058 0.0188
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0262 0.0842
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0079 0.0093
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.0229 0.027
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0228 0.0228
Brugia malayi hypothetical protein 0.0235 0.2645 0.8485
Echinococcus granulosus leukotriene A 4 hydrolase 0.023 0.2584 0.3056
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0303 0.3523 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0277 0.0888
Brugia malayi Mitochondrial import inner membrane translocase subunit TIM10 0.0047 0.0229 0.0735
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.0313 0.0313
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0277 1
Echinococcus multilocularis microtubule associated protein 2 0.0686 0.8453 0.8453

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.