Detailed information for compound 619818

Basic information

Technical information
  • TDR Targets ID: 619818
  • Name: N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]su lfanyl-1,3,4-thiadiazol-2-yl]pentanamide
  • MW: 357.475 | Formula: C12H15N5O2S3
  • H donors: 2 H acceptors: 5 LogP: 2.36 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCC(=O)Nc1nnc(s1)SCC(=O)Nc1nccs1
  • InChi: 1S/C12H15N5O2S3/c1-2-3-4-8(18)14-11-16-17-12(22-11)21-7-9(19)15-10-13-5-6-20-10/h5-6H,2-4,7H2,1H3,(H,13,15,19)(H,14,16,18)
  • InChiKey: ZMMHMNSGIXVAHJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[5-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pentanamide
  • N-[5-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]pentanamide
  • N-[5-[[2-keto-2-(thiazol-2-ylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]valeramide
  • ZINC04078118
  • Oprea1_633226

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
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 0.2057
Schistosoma mansoni myelin transcription factor 1 myt1 0.0055 0.0871 0.0678
Brugia malayi mbt repeat family protein 0.0048 0.0667 0.0891
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 0.2057
Loa Loa (eye worm) hypothetical protein 0.0055 0.0871 0.0864
Schistosoma mansoni hypothetical protein 0.0039 0.0391 0.0187
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0048 0.0667 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0763 0.0567
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0667 0.047
Mycobacterium ulcerans glutaminase 0.0268 0.7415 1
Schistosoma mansoni hypothetical protein 0.0292 0.8146 0.8106
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.0944 0.1264
Brugia malayi beta-lactamase family protein 0.0036 0.0306 0.0403
Brugia malayi hypothetical protein 0.0036 0.0294 0.0387
Mycobacterium tuberculosis Conserved protein 0.0036 0.0306 0.0475
Echinococcus granulosus geminin 0.0171 0.4425 0.4308
Echinococcus multilocularis polycomb protein SCMH1 0.0048 0.0667 0.047
Schistosoma mansoni glutaminase 0.0268 0.7415 0.736
Mycobacterium leprae Probable lipase LipE 0.0036 0.0306 0.2
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0763 0.1019
Entamoeba histolytica hypothetical protein 0.0038 0.0351 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Trichomonas vaginalis esterase, putative 0.0036 0.0306 0.0393
Entamoeba histolytica hypothetical protein 0.0038 0.0351 1
Onchocerca volvulus 0.0036 0.0306 0.4529
Loa Loa (eye worm) mbt repeat family protein 0.0048 0.0667 0.066
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0055 0.0871 0.0678
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.0008 0.0049
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0306 0.1436
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.1531 1
Onchocerca volvulus 0.0048 0.0667 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0763 0.0567
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0306 0.0393
Loa Loa (eye worm) hypothetical protein 0.0076 0.1531 0.1525
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0306 0.0475
Trypanosoma brucei PAB1-binding protein , putative 0.0056 0.0898 1
Loa Loa (eye worm) hypothetical protein 0.0056 0.0898 0.0891
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.0351 0.0147
Brugia malayi mbt repeat family protein 0.0048 0.0667 0.0891
Brugia malayi beta-lactamase 0.0036 0.0306 0.0403
Schistosoma mansoni tar DNA-binding protein 0.0199 0.5293 0.5193
Trichomonas vaginalis glutaminase, putative 0.0268 0.7415 1
Brugia malayi hypothetical protein 0.0056 0.0898 0.1202
Plasmodium vivax importin-beta 2, putative 0.0033 0.0207 0.1353
Echinococcus granulosus SAM and MBT domain containing protein 0.0048 0.0667 0.047
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.0944 0.1264
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Echinococcus multilocularis snurportin 1 0.0353 1 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0056 0.0898 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Brugia malayi TAR-binding protein 0.0199 0.5293 0.7135
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0391 0.0517
Toxoplasma gondii ABC1 family protein 0.0036 0.0306 0.2
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.1531 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0306 0.0393
Echinococcus granulosus histone acetyltransferase MYST2 0.0055 0.0871 0.0678
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.0727 0.1143
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0048 0.0667 0.047
Loa Loa (eye worm) TAR-binding protein 0.0199 0.5293 0.5289
Entamoeba histolytica hypothetical protein 0.0027 0.0016 0.0238
Echinococcus multilocularis tar DNA binding protein 0.0199 0.5293 0.5193
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0189 0.4997 0.4891
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0027 0.0008 0.0049
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 0.5
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.0306 0.0403
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Plasmodium falciparum ataxin-2 like protein, putative 0.0056 0.0898 0.5864
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Brugia malayi RNA recognition motif domain containing protein 0.0199 0.5293 0.7135
Mycobacterium ulcerans lipase LipD 0.0036 0.0306 0.0403
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.0351 0.0147
Schistosoma mansoni tar DNA-binding protein 0.0199 0.5293 0.5193
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.0727 0.1143
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0306 0.0475
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0763 0.0567
Brugia malayi glutaminase DH11.1 0.0268 0.7415 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0763 0.0567
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 0.5
Plasmodium vivax ataxin-2 like protein, putative 0.0056 0.0898 0.5864
Schistosoma mansoni hypothetical protein 0.0171 0.4425 0.4308
Entamoeba histolytica hypothetical protein 0.0038 0.0351 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0763 0.0567
Echinococcus granulosus polycomb protein SCMH1 0.0048 0.0667 0.047
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 0.1531 1
Mycobacterium ulcerans hypothetical protein 0.0036 0.0306 0.0403
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0306 0.3294
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0306 0.0393
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0306 0.0475
Leishmania major hypothetical protein, conserved 0.0056 0.0898 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0763 0.0567
Echinococcus multilocularis histone acetyltransferase MYST2 0.0055 0.0871 0.0678
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0306 0.3294
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0306 0.0403
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0306 0.0101
Echinococcus granulosus tar DNA binding protein 0.0199 0.5293 0.5193
Leishmania major hypothetical protein, conserved 0.0036 0.0306 0.3356
Brugia malayi RNA, U transporter 1 0.0094 0.2073 0.2789
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0306 0.0101
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 0.1531 0.1352
Mycobacterium tuberculosis Conserved protein 0.0036 0.0306 0.0475
Entamoeba histolytica hypothetical protein 0.0038 0.0351 1
Mycobacterium tuberculosis Conserved protein 0.0036 0.0306 0.0475
Loa Loa (eye worm) hypothetical protein 0.0036 0.0306 0.0299
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0306 0.0475
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0306 0.2
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.0944 0.0937
Schistosoma mansoni hypothetical protein 0.0038 0.0351 0.0147
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 0.5
Schistosoma mansoni tar DNA-binding protein 0.0199 0.5293 0.5193
Mycobacterium ulcerans beta-lactamase 0.0036 0.0306 0.0403
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0306 0.0475
Schistosoma mansoni hypothetical protein 0.0353 1 1
Echinococcus multilocularis geminin 0.0171 0.4425 0.4308
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0232 0.6295 1
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.0351 0.0147
Loa Loa (eye worm) hypothetical protein 0.0033 0.0207 0.02
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0763 0.0567
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0189 0.4997 0.4891
Schistosoma mansoni tar DNA-binding protein 0.0199 0.5293 0.5193
Brugia malayi Importin beta-1 subunit 0.0033 0.0207 0.0269
Loa Loa (eye worm) hypothetical protein 0.0057 0.0944 0.0937
Plasmodium falciparum ataxin-2 like protein, putative 0.0056 0.0898 0.5864
Loa Loa (eye worm) glutaminase 2 0.0268 0.7415 0.7413
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0763 0.0756
Loa Loa (eye worm) hypothetical protein 0.0048 0.0667 0.066
Loa Loa (eye worm) beta-lactamase 0.0036 0.0306 0.0299
Loa Loa (eye worm) RNA binding protein 0.0199 0.5293 0.5289
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0306 0.0299
Loa Loa (eye worm) hypothetical protein 0.0039 0.0391 0.0383
Onchocerca volvulus 0.0036 0.0306 0.4529
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0667 0.047
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 0.1531 0.1352
Plasmodium falciparum importin beta, putative 0.0033 0.0207 0.1353
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0306 0.0393
Echinococcus granulosus peptidase Clp S14 family 0.005 0.0727 0.053
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0306 0.2
Loa Loa (eye worm) glutaminase 0.0268 0.7415 0.7413
Schistosoma mansoni tar DNA-binding protein 0.0199 0.5293 0.5193
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 0.1531 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 0.1531 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 0.1531 0.1352
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0306 0.0475
Toxoplasma gondii HEAT repeat-containing protein 0.0033 0.0207 0.1353
Brugia malayi RNA binding protein 0.0199 0.5293 0.7135
Brugia malayi beta-lactamase family protein 0.0036 0.0306 0.0403
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0306 0.0475
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0306 0.0393
Onchocerca volvulus 0.0036 0.0306 0.4529
Schistosoma mansoni hypothetical protein 0.0171 0.4425 0.4308
Loa Loa (eye worm) MBCTL1 0.0055 0.0871 0.0864
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.0727 0.053
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.0727 0.4744
Toxoplasma gondii LsmAD domain-containing protein 0.0056 0.0898 0.5864
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0306 0.0101
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0199 0.5293 0.5289
Leishmania major importin beta-1 subunit, putative 0.0027 0.0016 0.0092
Brugia malayi Probable ClpP-like protease 0.0076 0.1531 0.2057
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0055 0.0871 0.1166
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0353 1 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0306 0.0101
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.0306 0.0403
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0055 0.0871 0.0678
Brugia malayi hypothetical protein 0.0038 0.0351 0.0464
Echinococcus multilocularis SAM and MBT domain containing protein 0.0048 0.0667 0.047
Trypanosoma cruzi PAB1-binding protein , putative 0.0056 0.0898 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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