Detailed information for compound 611066

Basic information

Technical information
  • TDR Targets ID: 611066
  • Name: 4-cyano-N-[4-(2,4-dimethylphenyl)-1,3-thiazol -2-yl]benzamide
  • MW: 333.407 | Formula: C19H15N3OS
  • H donors: 1 H acceptors: 3 LogP: 4.23 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1ccc(cc1)C(=O)Nc1scc(n1)c1ccc(cc1C)C
  • InChi: 1S/C19H15N3OS/c1-12-3-8-16(13(2)9-12)17-11-24-19(21-17)22-18(23)15-6-4-14(10-20)5-7-15/h3-9,11H,1-2H3,(H,21,22,23)
  • InChiKey: RONPEOZACYFXNO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-cyano-N-[4-(2,4-dimethylphenyl)thiazol-2-yl]benzamide
  • 4-cyano-N-[4-(2,4-dimethylphenyl)-2-thiazolyl]benzamide
  • Oprea1_809848
  • ZINC00567701

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 histone lysine methyltransferase SET/SUV39 0.0031 0.0095 0.0327
Brugia malayi ImpB/MucB/SamB family protein 0.0047 0.0333 0.055
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.011 0.1258 0.2598
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0054 0.0435 0.3153
Onchocerca volvulus 0.0037 0.0183 0.0277
Loa Loa (eye worm) hypothetical protein 0.0047 0.0333 0.055
Schistosoma mansoni tar DNA-binding protein 0.0328 0.4479 0.8934
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0147 0.1798 0.3483
Echinococcus granulosus dna polymerase eta 0.0047 0.0333 0.0519
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0037 0.0183 0.1061
Echinococcus granulosus geminin 0.0364 0.5003 1
Schistosoma mansoni tar DNA-binding protein 0.0328 0.4479 0.8934
Echinococcus multilocularis solute carrier family 5 0.0037 0.0183 0.0199
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.034 0.0519
Loa Loa (eye worm) hypothetical protein 0.0037 0.0183 0.0217
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0217 0.2838 0.6097
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0147 0.1798 0.3483
Trypanosoma cruzi DNA polymerase eta, putative 0.0047 0.0333 0.2651
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0095 0.002
Loa Loa (eye worm) hypothetical protein 0.0048 0.034 0.0566
Leishmania major hypothetical protein, conserved 0.011 0.1258 1
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1258 1
Mycobacterium tuberculosis Probable esterase LipL 0.011 0.1258 0.0861
Trypanosoma cruzi DNA polymerase eta, putative 0.0033 0.0126 0.1002
Echinococcus granulosus sodium:myo inositol cotransporter 0.0037 0.0183 0.0213
Schistosoma mansoni inositol transporter 0.0037 0.0183 0.0199
Schistosoma mansoni peptidase Clp (S14 family) 0.0083 0.0855 0.1565
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0325 0.4434 0.9633
Mycobacterium tuberculosis Conserved protein 0.011 0.1258 0.0861
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.011 0.1258 0.2598
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0147 0.1798 0.3483
Schistosoma mansoni DNA polymerase eta 0.0047 0.0333 0.0505
Loa Loa (eye worm) TAR-binding protein 0.0328 0.4479 0.9733
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0147 0.1798 0.3794
Mycobacterium tuberculosis Probable lipase LipD 0.011 0.1258 0.0861
Mycobacterium tuberculosis Probable hydrolase 0.011 0.1258 0.0861
Echinococcus granulosus sodium:glucose cotransporter 2 0.0037 0.0183 0.0213
Echinococcus multilocularis geminin 0.0364 0.5003 1
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0083 0.0855 0.5
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0083 0.0855 1
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1258 0.3835
Brugia malayi beta-lactamase family protein 0.011 0.1258 0.2598
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0147 0.1798 0.3492
Loa Loa (eye worm) RNA binding protein 0.0328 0.4479 0.9733
Echinococcus granulosus high affinity choline transporter 1 0.0336 0.46 0.918
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1258 1
Schistosoma mansoni tar DNA-binding protein 0.0328 0.4479 0.8934
Schistosoma mansoni sodium/solute symporter 0.0037 0.0183 0.0199
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0147 0.1798 0.3492
Onchocerca volvulus 0.0048 0.034 0.0771
Onchocerca volvulus 0.0247 0.328 1
Echinococcus granulosus sodium:glucose cotransporter 0.0037 0.0183 0.0213
Brugia malayi Pre-SET motif family protein 0.0031 0.0095 0.0022
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0037 0.0183 0.0199
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0037 0.0183 0.0213
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1258 0.3835
Echinococcus granulosus solute carrier family 5 0.0037 0.0183 0.0213
Mycobacterium leprae conserved hypothetical protein 0.011 0.1258 1
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Mycobacterium leprae Probable lipase LipE 0.011 0.1258 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0083 0.0855 0.6646
Echinococcus multilocularis dna polymerase eta 0.0047 0.0333 0.0505
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0083 0.0855 1
Brugia malayi Pre-SET motif family protein 0.0217 0.2838 0.6097
Plasmodium vivax importin-beta 2, putative 0.003 0.0085 0.0245
Echinococcus granulosus peptidase Clp S14 family 0.0054 0.0435 0.0724
Brugia malayi beta-lactamase 0.011 0.1258 0.2598
Echinococcus granulosus snurportin 1 0.0325 0.4434 0.8844
Brugia malayi RNA binding protein 0.0328 0.4479 0.9733
Echinococcus multilocularis tumor protein p63 0.0326 0.4451 0.8877
Schistosoma mansoni hypothetical protein 0.0325 0.4434 0.8842
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1258 0.2385
Loa Loa (eye worm) hypothetical protein 0.0336 0.46 1
Onchocerca volvulus 0.011 0.1258 0.3651
Plasmodium vivax SET domain protein, putative 0.0031 0.0095 0.0327
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.011 0.1258 1
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Schistosoma mansoni tar DNA-binding protein 0.0328 0.4479 0.8934
Plasmodium falciparum importin beta, putative 0.003 0.0085 0.0369
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0083 0.0855 0.1565
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0147 0.1798 0.3483
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0147 0.1798 0.3794
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0095 0.002
Brugia malayi Sodium:solute symporter family protein 0.0037 0.0183 0.0217
Mycobacterium tuberculosis Probable lipase LipE 0.011 0.1258 0.0861
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1258 0.3835
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0085 0.0245
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.011 0.1258 0.0861
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0083 0.0855 0.1577
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0095 0.002
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0095 0.002
Onchocerca volvulus 0.011 0.1258 0.3651
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0083 0.0855 0.6646
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0037 0.0183 0.0199
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.0855 0.6646
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.011 0.1258 0.0861
Trypanosoma brucei DNA polymerase eta, putative 0.0047 0.0333 0.2118
Mycobacterium ulcerans lipase LipD 0.011 0.1258 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.0855 0.5
Schistosoma mansoni high-affinity choline transporter 0.0336 0.46 0.9179
Echinococcus granulosus importin subunit beta 1 0.003 0.0085 0.0014
Schistosoma mansoni inositol transporter 0.0037 0.0183 0.0199
Trichomonas vaginalis set domain proteins, putative 0.0247 0.328 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0095 0.0022
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.0855 0.5
Brugia malayi beta-lactamase family protein 0.011 0.1258 0.2598
Mycobacterium ulcerans beta-lactamase 0.011 0.1258 1
Brugia malayi Probable ClpP-like protease 0.0083 0.0855 0.1705
Mycobacterium tuberculosis Conserved protein 0.011 0.1258 0.0861
Onchocerca volvulus 0.011 0.1258 0.3651
Echinococcus granulosus beta LACTamase domain containing family member 0.011 0.1258 0.2396
Echinococcus multilocularis beta LACTamase domain containing family member 0.011 0.1258 0.2385
Brugia malayi RNA recognition motif domain containing protein 0.0328 0.4479 0.9733
Schistosoma mansoni hypothetical protein 0.0364 0.5003 1
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1258 0.3835
Echinococcus granulosus tar DNA binding protein 0.0328 0.4479 0.8936
Leishmania major DNA polymerase eta, putative 0.0033 0.0126 0.1002
Echinococcus multilocularis tar DNA binding protein 0.0328 0.4479 0.8934
Mycobacterium tuberculosis Probable conserved lipoprotein 0.011 0.1258 0.0861
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0037 0.0183 0.0199
Echinococcus multilocularis peptidase Clp (S14 family) 0.0054 0.0435 0.0711
Toxoplasma gondii ABC1 family protein 0.011 0.1258 1
Echinococcus multilocularis high affinity choline transporter 1 0.0336 0.46 0.9179
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0147 0.1798 0.3483
Loa Loa (eye worm) beta-lactamase 0.011 0.1258 0.2598
Plasmodium vivax hypothetical protein, conserved 0.011 0.1258 1
Echinococcus multilocularis snurportin 1 0.0325 0.4434 0.8842
Echinococcus granulosus tumor protein p63 0.0326 0.4451 0.8879
Trypanosoma brucei hypothetical protein, conserved 0.011 0.1258 1
Leishmania major DNA polymerase eta, putative 0.0047 0.0333 0.2651
Entamoeba histolytica hypothetical protein 0.0025 0 0.5
Loa Loa (eye worm) hypothetical protein 0.011 0.1258 0.2598
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.0855 0.6646
Brugia malayi TAR-binding protein 0.0328 0.4479 0.9733
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0033 0.0126 0.0586
Mycobacterium tuberculosis Conserved protein 0.011 0.1258 0.0861
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0095 0.002
Mycobacterium ulcerans hypothetical protein 0.011 0.1258 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0095 0.002
Loa Loa (eye worm) hypothetical protein 0.0083 0.0855 0.1705
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1258 0.2385
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0328 0.4479 0.9733
Schistosoma mansoni tar DNA-binding protein 0.0328 0.4479 0.8934
Brugia malayi GH02984p 0.0336 0.46 1
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1258 0.3835
Brugia malayi RNA, U transporter 1 0.0087 0.0914 0.1836
Mycobacterium ulcerans esterase/lipase LipP 0.011 0.1258 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0095 0.0034
Trichomonas vaginalis esterase, putative 0.011 0.1258 0.3835
Schistosoma mansoni hypothetical protein 0.0364 0.5003 1

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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