Detailed information for compound 718177

Basic information

Technical information
  • TDR Targets ID: 718177
  • Name: 2-(3,4-dichlorophenyl)-N-(5-ethyl-1,3,4-thiad iazol-2-yl)acetamide
  • MW: 316.206 | Formula: C12H11Cl2N3OS
  • H donors: 1 H acceptors: 3 LogP: 3.56 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1nnc(s1)NC(=O)Cc1ccc(c(c1)Cl)Cl
  • InChi: 1S/C12H11Cl2N3OS/c1-2-11-16-17-12(19-11)15-10(18)6-7-3-4-8(13)9(14)5-7/h3-5H,2,6H2,1H3,(H,15,17,18)
  • InChiKey: IASHGBRUDNIKOF-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-(3,4-dichlorophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanamide
  • ZINC01056110
  • IVK/4006800

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 amine oxidase 0.0042 0.042 0.0552
Plasmodium vivax flavodoxin domain containing protein 0.0056 0.0676 0.8159
Echinococcus multilocularis acetylcholinesterase 0.0202 0.3215 0.7021
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0034 0.0289 0.0631
Onchocerca volvulus 0.0034 0.0289 0.2413
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0063 0.0802 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0453 0.7611 1
Schistosoma mansoni hypothetical protein 0.0019 0.0033 0.0044
Onchocerca volvulus 0.0034 0.0289 0.2413
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0027 0.0162 0.0353
Echinococcus multilocularis methionine synthase reductase 0.0039 0.0378 0.0826
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0063 0.0802 0.1751
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0027 0.0162 0.0353
Entamoeba histolytica type A flavoprotein, putative 0.0024 0.0118 0.5
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0042 0.042 0.5
Brugia malayi hypothetical protein 0.0034 0.0289 0.038
Echinococcus granulosus lysine specific histone demethylase 1A 0.0042 0.042 0.0917
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0063 0.0802 0.0528
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0035 0.0299 0.0652
Brugia malayi hypothetical protein 0.0042 0.042 0.0552
Echinococcus multilocularis BC026374 protein (S09 family) 0.0034 0.0289 0.0631
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0042 0.042 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0034 0.0289 0.038
Loa Loa (eye worm) hypothetical protein 0.0028 0.0191 0.025
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0027 0.0162 0.0212
Echinococcus granulosus carboxylesterase 5A 0.0202 0.3215 0.7021
Brugia malayi amine oxidase, flavin-containing family protein 0.0042 0.042 0.0552
Toxoplasma gondii histone lysine-specific demethylase 0.0042 0.042 1
Echinococcus multilocularis neuropeptide s receptor 0.028 0.458 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0202 0.3215 0.4225
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Onchocerca volvulus 0.0034 0.0289 0.2413
Mycobacterium ulcerans dehydrogenase 0.0042 0.042 0.0135
Loa Loa (eye worm) FAD binding domain-containing protein 0.0039 0.0378 0.0497
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0063 0.0802 0.1751
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0027 0.0162 0.0353
Echinococcus granulosus BC026374 protein S09 family 0.0034 0.0289 0.0631
Trichomonas vaginalis sulfite reductase, putative 0.0063 0.0802 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0028 0.0191 0.025
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0063 0.0802 1
Loa Loa (eye worm) hypothetical protein 0.0202 0.3215 0.4225
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0035 0.0299 0.2644
Brugia malayi FAD binding domain containing protein 0.0063 0.0802 0.1054
Brugia malayi hypothetical protein 0.0086 0.1198 0.1575
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0028 0.0191 0.025
Echinococcus multilocularis 0.0042 0.042 0.0917
Loa Loa (eye worm) hypothetical protein 0.0019 0.0033 0.0044
Echinococcus granulosus acetylcholinesterase 0.0202 0.3215 0.7021
Brugia malayi Carboxylesterase family protein 0.0034 0.0289 0.038
Brugia malayi Carboxylesterase family protein 0.0034 0.0289 0.038
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0035 0.0299 0.0011
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0039 0.0378 0.0497
Brugia malayi flavodoxin family protein 0.0024 0.0118 0.0155
Trypanosoma cruzi UDP-galactopyranose mutase 0.0042 0.042 0.4417
Schistosoma mansoni aldehyde dehydrogenase 0.0035 0.0299 0.0392
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0549 0.9274 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0042 0.042 0.4417
Echinococcus multilocularis acetylcholinesterase 0.0202 0.3215 0.7021
Echinococcus granulosus neuroligin 0.0034 0.0289 0.0631
Brugia malayi Carboxylesterase family protein 0.0034 0.0289 0.038
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0056 0.0676 0.8159
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0453 0.7611 1
Onchocerca volvulus 0.0042 0.042 0.3504
Brugia malayi FAD binding domain containing protein 0.0039 0.0378 0.0497
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.059 1 1
Brugia malayi Cytochrome P450 family protein 0.0019 0.0019 0.0025
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0034 0.0289 0.0631
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0042 0.042 0.0917
Mycobacterium ulcerans aldehyde dehydrogenase 0.0035 0.0299 0.001
Loa Loa (eye worm) carboxylesterase 0.0202 0.3215 0.4225
Trypanosoma cruzi p450 reductase, putative 0.0063 0.0802 1
Plasmodium falciparum protoporphyrinogen oxidase 0.0042 0.042 0.4417
Echinococcus granulosus neuropeptide s receptor 0.028 0.458 1
Echinococcus granulosus acetylcholinesterase 0.0202 0.3215 0.7021
Schistosoma mansoni acetylcholinesterase 0.0034 0.0289 0.038
Echinococcus multilocularis protoporphyrinogen oxidase 0.0042 0.042 0.0917
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Entamoeba histolytica type A flavoprotein, putative 0.0024 0.0118 0.5
Loa Loa (eye worm) acetylcholinesterase 1 0.0202 0.3215 0.4225
Toxoplasma gondii aldehyde dehydrogenase 0.0035 0.0299 0.3116
Chlamydia trachomatis protoporphyrinogen oxidase 0.0042 0.042 1
Echinococcus granulosus methionine synthase reductase 0.0039 0.0378 0.0826
Giardia lamblia Nitric oxide synthase, inducible 0.0056 0.0676 0.5
Schistosoma mansoni neuroligin 3 (S09 family) 0.0034 0.0289 0.038
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0063 0.0802 1
Brugia malayi flavodoxin family protein 0.0063 0.0802 0.1054
Echinococcus multilocularis para nitrobenzyl esterase 0.0034 0.0289 0.0631
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0042 0.042 0.4417
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0027 0.0162 0.0212
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0042 0.042 0.4417
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Brugia malayi Carboxylesterase family protein 0.0034 0.0289 0.038
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0063 0.0802 0.1751
Schistosoma mansoni aldehyde dehydrogenase 0.0035 0.0299 0.0392
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0042 0.042 0.0552
Brugia malayi Carboxylesterase family protein 0.0202 0.3215 0.4225
Schistosoma mansoni NADPH flavin oxidoreductase 0.0032 0.0252 0.0331
Loa Loa (eye worm) FAD binding domain-containing protein 0.0063 0.0802 0.1054
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Loa Loa (eye worm) carboxylesterase 0.0034 0.0289 0.038
Echinococcus granulosus lysine specific histone demethylase 1A 0.0042 0.042 0.0917
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0063 0.0802 1
Schistosoma mansoni BC026374 protein (S09 family) 0.0034 0.0289 0.038
Loa Loa (eye worm) hypothetical protein 0.0202 0.3215 0.4225
Brugia malayi latrophilin 2 splice variant baaae 0.0019 0.0033 0.0044
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0063 0.0802 0.1751
Schistosoma mansoni amine oxidase 0.0042 0.042 0.0552
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0027 0.0162 0.0353
Mycobacterium tuberculosis Conserved hypothetical protein 0.0042 0.042 0.0146
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0042 0.042 0.0552
Loa Loa (eye worm) hypothetical protein 0.0453 0.7611 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0027 0.0162 0.0212
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0027 0.0162 0.0212
Echinococcus granulosus neuropeptide receptor A26 0.028 0.458 1
Plasmodium falciparum nitric oxide synthase, putative 0.0063 0.0802 1
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0063 0.0802 1
Loa Loa (eye worm) flavodoxin family protein 0.0024 0.0118 0.0155
Mycobacterium ulcerans oxidoreductase 0.0042 0.042 0.0135
Brugia malayi Calcitonin receptor-like protein seb-1 0.0028 0.0191 0.025
Echinococcus multilocularis neuropeptide receptor A26 0.028 0.458 1
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0063 0.0802 1
Entamoeba histolytica type A flavoprotein, putative 0.0024 0.0118 0.5
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0035 0.0299 0.0652
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0034 0.0289 0.038
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0042 0.042 0.0135
Mycobacterium ulcerans monoamine oxidase 0.0042 0.042 0.0135
Schistosoma mansoni diflavin oxidoreductase 0.0031 0.0244 0.032
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Loa Loa (eye worm) hypothetical protein 0.0063 0.0802 0.1054
Entamoeba histolytica type A flavoprotein, putative 0.0024 0.0118 0.5
Echinococcus multilocularis carboxylesterase 5A 0.0202 0.3215 0.7021
Echinococcus multilocularis neuroligin 0.0034 0.0289 0.0631
Mycobacterium ulcerans aldehyde dehydrogenase 0.0035 0.0299 0.001
Brugia malayi Carboxylesterase family protein 0.0202 0.3215 0.4225
Mycobacterium tuberculosis Possible oxidoreductase 0.0042 0.042 0.0146
Leishmania major cytochrome P450 reductase, putative 0.0056 0.0676 0.8159
Echinococcus granulosus para nitrobenzyl esterase 0.0034 0.0289 0.0631
Loa Loa (eye worm) cytochrome P450 family protein 0.0019 0.0019 0.0025
Plasmodium vivax hypothetical protein, conserved 0.0042 0.042 0.4417
Loa Loa (eye worm) hypothetical protein 0.0086 0.1198 0.1575
Mycobacterium ulcerans aldehyde dehydrogenase 0.0035 0.0299 0.001
Plasmodium vivax hypothetical protein, conserved 0.0042 0.042 0.4417
Onchocerca volvulus 0.0086 0.1198 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.042 0.0552
Entamoeba histolytica type A flavoprotein, putative 0.0024 0.0118 0.5
Loa Loa (eye worm) carboxylesterase 0.0034 0.0289 0.038
Schistosoma mansoni cytochrome P450 reductase 0.0063 0.0802 0.1054
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0063 0.0802 1
Brugia malayi SWIRM domain containing protein 0.0042 0.042 0.0552
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0034 0.0289 0.038
Loa Loa (eye worm) hypothetical protein 0.0399 0.6659 0.875
Giardia lamblia Hypothetical protein 0.0056 0.0676 0.5
Leishmania major UDP-galactopyranose mutase 0.0042 0.042 0.4417
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0027 0.0162 0.0212
Loa Loa (eye worm) hypothetical protein 0.0453 0.7611 1
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0034 0.0289 0.2504
Leishmania major p450 reductase, putative 0.0063 0.0802 1
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0063 0.0802 1
Treponema pallidum flavodoxin 0.0024 0.0118 0.5
Onchocerca volvulus 0.0034 0.0289 0.2413
Trypanosoma cruzi UDP-galactopyranose mutase 0.0042 0.042 0.4417
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0063 0.0802 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0289 0.038
Trichomonas vaginalis spcc417.12 protein, putative 0.0034 0.0289 0.2504
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0042 0.042 0.4417
Onchocerca volvulus 0.0034 0.0289 0.2413
Schistosoma mansoni gliotactin 0.0034 0.0289 0.038

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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