Detailed information for compound 685784

Basic information

Technical information
  • TDR Targets ID: 685784
  • Name: 6-(4-fluorophenyl)-N-[4-fluoro-3-(trifluorome thyl)phenyl]-3-methylimidazo[2,1-b][1,3]thiaz ole-2-carboxamide
  • MW: 437.386 | Formula: C20H12F5N3OS
  • H donors: 1 H acceptors: 2 LogP: 6.18 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)c1nc2n(c1)c(c(s2)C(=O)Nc1ccc(c(c1)C(F)(F)F)F)C
  • InChi: 1S/C20H12F5N3OS/c1-10-17(18(29)26-13-6-7-15(22)14(8-13)20(23,24)25)30-19-27-16(9-28(10)19)11-2-4-12(21)5-3-11/h2-9H,1H3,(H,26,29)
  • InChiKey: HJLNVCNZVKLWGN-UHFFFAOYSA-N  

Network

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Synonyms

  • 6-(4-fluorophenyl)-N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-methyl-imidazo[2,1-b]thiazole-2-carboxamide
  • 6-(4-fluorophenyl)-N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-methyl-2-imidazo[2,1-b]thiazolecarboxamide
  • 6-(4-fluorophenyl)-N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-methyl-imidazo[2,1-b][1,3]thiazole-2-carboxamide

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 mixed-lineage leukemia protein mll 0.0007 0.0531 0.0531
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.1246 0.1246
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0006 0.0316 0.0316
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.1246 0.2359
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.1246 0.2359
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.1246 0.2524
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0839 0.1538
Loa Loa (eye worm) hypothetical protein 0.0006 0.0316 0.027
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.1246 0.2524
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.1246 0.2359
Brugia malayi acetyl-Coenzyme A synthetase 2 0.0008 0.0633 0.1037
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0008 0.0633 0.0546
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.1246 0.2524
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.1246 0.2359
Onchocerca volvulus 0.0008 0.0633 0.1037
Loa Loa (eye worm) hypothetical protein 0.0006 0.0316 0.027
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.1246 0.2524
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.1246 0.2359
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.1246 0.2359
Brugia malayi AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.002 0.273 0.6617
Brugia malayi AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Loa Loa (eye worm) hypothetical protein 0.002 0.273 0.612
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.1246 0.2524
Brugia malayi ecdysteroid receptor 0.0011 0.1246 0.2524
Echinococcus granulosus cpg binding protein 0.003 0.4619 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.2541 0.6071
Brugia malayi AMP-binding enzyme family protein 0.0026 0.3899 0.8953
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.002 0.273 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.1246 0.2524
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.1246 0.2359
Schistosoma mansoni nuclear hormone receptor 0.0011 0.1246 0.1246
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.1246 0.2359
Mycobacterium ulcerans fatty-acid-CoA ligase 0.002 0.273 0.6421
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.1246 0.2524
Schistosoma mansoni nuclear receptor 0.0005 0.0205 0.0205
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0008 0.0633 0.0546
Entamoeba histolytica acyl-coA synthetase, putative 0.0026 0.3899 1
Trypanosoma brucei long-chain-fatty-acid-CoA ligase, putative 0.0008 0.0633 0.5
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0008 0.0633 0.0546
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0008 0.0633 0.0546
Schistosoma mansoni cpg binding protein 0.0029 0.4331 0.4331
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.1246 0.2524
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.1246 0.2524
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.1246 0.1246
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.2541 0.6071
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.1246 0.1246
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0531 0.0739
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0026 0.3899 1
Onchocerca volvulus 0.0026 0.3899 0.8953
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.1246 0.2524
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.1246 0.2359
Loa Loa (eye worm) hypothetical protein 0.002 0.273 0.612
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.4331 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0005 0.0205 0.0205
Brugia malayi nuclear hormone receptor 0.0011 0.1246 0.2524
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.1246 0.2524
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0839 0.1437
Brugia malayi AMP-binding enzyme family protein 0.0026 0.3899 0.8953
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0633 0.1037
Brugia malayi AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Mycobacterium ulcerans hypothetical protein 0.0026 0.3899 1
Schistosoma mansoni coup transcription factor 0.0011 0.1246 0.1246
Schistosoma mansoni cpg binding protein 0.003 0.4619 0.4619
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0531 0.0739
Loa Loa (eye worm) oxidoreductase 0.0008 0.0633 0.1037
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.1246 0.2524
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.1246 0.2359
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.1246 0.2524
Onchocerca volvulus 0.0029 0.4331 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.3899 0.8953
Loa Loa (eye worm) hypothetical protein 0.0006 0.0316 0.027
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0026 0.3899 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.1246 0.2524
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.1246 0.2524
Onchocerca volvulus 0.0008 0.0633 0.1037
Schistosoma mansoni zinc finger protein 0.0005 0.0205 0.0205
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.1246 0.2524
Trichomonas vaginalis antibiotic synthetase, putative 0.0008 0.0633 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.2541 0.6071
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0008 0.0633 0.0969
Loa Loa (eye worm) hypothetical protein 0.0026 0.3899 0.8953
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.1246 0.2524
Schistosoma mansoni nuclear receptor 0.0005 0.0205 0.0205
Brugia malayi nuclear receptor RXR 0.0006 0.0316 0.027
Loa Loa (eye worm) hypothetical protein 0.002 0.273 0.612
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0008 0.0633 0.5
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0008 0.0633 0.0546
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.3899 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.1246 0.2524
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.1246 0.1246
Brugia malayi AMP-binding enzyme family protein 0.0026 0.3899 0.8953
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.8854 1
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0819 0.1489
Schistosoma mansoni thyroid hormone receptor 0.0011 0.1246 0.1246
Loa Loa (eye worm) hypothetical protein 0.002 0.273 0.612
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0026 0.3899 1
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0008 0.0633 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.1246 0.1246
Schistosoma mansoni nuclear hormone receptor 0.0005 0.0205 0.0205
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.2541 0.6071
Brugia malayi nuclear receptor NHR-88 0.0011 0.1246 0.2524
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.1246 0.1246
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0008 0.0633 0.0546
Schistosoma mansoni thyroid hormone receptor 0.0011 0.1246 0.1246
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0006 0.0316 0.0253
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.3899 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.1246 0.2524
Schistosoma mansoni nuclear hormone receptor 0.0005 0.0205 0.0205
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0026 0.3899 1
Brugia malayi hypothetical protein 0.0006 0.0316 0.027
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.1246 0.2524
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0008 0.0633 0.5
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0008 0.0633 0.5
Onchocerca volvulus 0.0008 0.0633 0.1037
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.1246 0.2359
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.1246 0.2359
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.1246 0.1246
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0008 0.0633 0.0546
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.1246 0.1246
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0006 0.0316 0.027
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Echinococcus granulosus FTZ F1 alpha 0.0011 0.1246 0.2359
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.1246 0.2359
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0839 0.1437
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0008 0.0633 0.0546
Trichomonas vaginalis antibiotic synthetase, putative 0.0008 0.0633 1
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0008 0.0633 0.0969
Loa Loa (eye worm) hypothetical protein 0.0026 0.3899 0.8953
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.1246 0.2524
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.3899 1
Plasmodium falciparum acyl-CoA synthetase 0.002 0.273 1
Onchocerca volvulus 0.0008 0.0633 0.1037
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0008 0.0633 0.0546
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.3899 1
Schistosoma mansoni cpg binding protein 0.003 0.4619 0.4619
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0026 0.3899 1
Plasmodium vivax acyl-CoA synthetase, putative 0.002 0.273 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.1246 0.2359
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.1246 0.2524
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.1246 0.2524
Echinococcus multilocularis cpg binding protein 0.003 0.4619 1
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.0316 0.027
Trypanosoma brucei acetyl-CoA synthetase, putative 0.0008 0.0633 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.1246 0.2359
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0006 0.0316 0.0316
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.1246 0.2524
Brugia malayi AMP-binding enzyme family protein 0.0008 0.0633 0.1037
Brugia malayi hypothetical protein 0.0006 0.0316 0.027
Loa Loa (eye worm) hypothetical protein 0.002 0.273 0.612
Schistosoma mansoni nuclear receptor nhr-48 0.0005 0.0205 0.0205
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.0316 0.027
Loa Loa (eye worm) hypothetical protein 0.0006 0.0316 0.027
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.3899 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0531 0.0739
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0006 0.0316 0.0253
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0005 0.0205 0.0205
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.3899 1
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0008 0.0633 0.0546
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.1246 0.2359
Onchocerca volvulus 0.0011 0.1246 0.2524
Loa Loa (eye worm) hypothetical protein 0.0008 0.0633 0.1037
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.1246 0.2359
Brugia malayi CXXC zinc finger family protein 0.0029 0.4331 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.1246 0.2524
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0026 0.3899 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0008 0.0633 0.0546
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0026 0.3899 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0026 0.3899 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.3899 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.1246 0.2524
Loa Loa (eye worm) hypothetical protein 0.0008 0.0633 0.1037
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.1246 0.2524
Schistosoma mansoni acetyl-CoA synthetase 0.0008 0.0633 0.0633
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0531 0.0739
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.3899 1
Brugia malayi steroid hormone receptor 0.0011 0.1246 0.2524
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.1246 0.1246
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.1246 0.2524
Loa Loa (eye worm) hypothetical protein 0.0006 0.0316 0.027

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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