Detailed information for compound 451381

Basic information

Technical information
  • TDR Targets ID: 451381
  • Name: 1-N,3-N-bis(1,3-thiazol-2-yl)benzene-1,3-dica rboxamide
  • MW: 330.385 | Formula: C14H10N4O2S2
  • H donors: 2 H acceptors: 4 LogP: 2.32 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1cccc(c1)C(=O)Nc1nccs1)Nc1nccs1
  • InChi: 1S/C14H10N4O2S2/c19-11(17-13-15-4-6-21-13)9-2-1-3-10(8-9)12(20)18-14-16-5-7-22-14/h1-8H,(H,15,17,19)(H,16,18,20)
  • InChiKey: MARWQHQTMLKNFJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N1,N3-di(thiazol-2-yl)benzene-1,3-dicarboxamide
  • N1,N3-bis(2-thiazolyl)benzene-1,3-dicarboxamide
  • N1,N3-bis(1,3-thiazol-2-yl)benzene-1,3-dicarboxamide
  • N,N'-di(thiazol-2-yl)isophthalamide
  • N,N'-bis(1,3-thiazol-2-yl)benzene-1,3-dicarboxamide
  • N,N'-di(thiazol-2-yl)benzene-1,3-dicarboxamide
  • N,N'-bis(2-thiazolyl)benzene-1,3-dicarboxamide
  • ST5300310
  • N,N'-Bis(2-thiazolyl)isophthalamide
  • BAS 00626160
  • N,N'-Bis-thiazol-2-yl-isophthalamide
  • Oprea1_549482
  • ZINC00535129

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 subtilisin SUB4 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Toxoplasma gondii subtilisin SUB11 0.0053 0.0854 1
Echinococcus multilocularis Furin 1 0.0053 0.0854 0.0684
Plasmodium vivax subtilisin-like serine protease, putative 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0182 0.0182
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Echinococcus granulosus neuroendocrine convertase 2 0.0053 0.0854 0.0684
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.0053 0.0854 0.5
Mycobacterium leprae Possible secreted protease 0.0053 0.0854 0.5
Echinococcus granulosus geminin 0.0164 0.4196 0.4088
Echinococcus multilocularis tumor protein p63 0.0331 0.9248 0.9234
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.0053 0.0854 0.5
Echinococcus multilocularis membrane bound transcription factor site 1 0.0356 1 1
Loa Loa (eye worm) hypothetical protein 0.0356 1 1
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.0053 0.0854 0.5
Echinococcus multilocularis geminin 0.0164 0.4196 0.4088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0592 0.0592
Toxoplasma gondii subtilisin SUB8 0.0053 0.0854 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0182 0.0182
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0717 0.0545
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Echinococcus granulosus Furin 1 0.0053 0.0854 0.0684
Toxoplasma gondii subtilisin SUB1 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0053 0.0854 0.0684
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Schistosoma mansoni hypothetical protein 0.0066 0.1259 0.1096
Schistosoma mansoni hypothetical protein 0.0164 0.4196 0.4088
Echinococcus multilocularis 0.0053 0.0854 0.0684
Trypanosoma cruzi subtilisin peptidase 0.0053 0.0854 1
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0854 0.5
Toxoplasma gondii subtilisin SUB12 0.0053 0.0854 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0592 0.0592
Plasmodium falciparum subtilisin-like protease 2 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Plasmodium vivax subtilisin-like protease 2, putative 0.0053 0.0854 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.1259 0.1259
Toxoplasma gondii subtilisin SUB9 0.0053 0.0854 1
Toxoplasma gondii subtilisin SUB6 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Loa Loa (eye worm) proprotein convertase 2 0.0053 0.0854 0.0854
Brugia malayi Hypothetical subtilase-type proteinase F21H12.6 in chromosome II 0.0053 0.0854 0.0854
Brugia malayi neuroendocrine convertase 1 precursor 0.0053 0.0854 0.0854
Brugia malayi Subtilase family protein 0.0053 0.0854 0.0854
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.0053 0.0854 0.5
Schistosoma mansoni site-1 peptidase (S08 family) 0.0053 0.0854 0.0684
Loa Loa (eye worm) hypothetical protein 0.0097 0.2186 0.2186
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0066 0.1259 0.1259
Toxoplasma gondii subtilisin SUB2 0.0053 0.0854 1
Toxoplasma gondii subtilisin SUB7 0.0053 0.0854 1
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0053 0.0854 0.0684
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0053 0.0854 1
Schistosoma mansoni tripeptidyl-peptidase II (S08 family) 0.0053 0.0854 0.0684
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0182 0.0182
Plasmodium vivax subtilisin-like protease 1 0.0053 0.0854 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0592 0.0417
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0182
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Schistosoma mansoni site-1 peptidase (S08 family) 0.0356 1 1
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0053 0.0854 1
Echinococcus multilocularis neuroendocrine convertase 2 0.0053 0.0854 0.0684
Loa Loa (eye worm) hypothetical protein 0.0048 0.0717 0.0717
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.0053 0.0854 0.5
Schistosoma mansoni furin-1 (S08 family) 0.0053 0.0854 0.0684
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Brugia malayi proprotein convertase 2 0.0053 0.0854 0.0854
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.0053 0.0854 0.5
Toxoplasma gondii subtilisin SUB5 0.0053 0.0854 1
Brugia malayi celfurPC protein 0.0053 0.0854 0.0854
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0592 0.0417
Loa Loa (eye worm) subtilase 0.0053 0.0854 0.0854
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0097 0.2186 0.2186
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0097 0.2186 0.2186
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.0053 0.0854 0.5
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0053 0.0854 0.0684
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0592 0.0417
Trypanosoma cruzi serine peptidase, clan SB, family S8-like protein 0.0053 0.0854 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0592 0.0417
Plasmodium falciparum subtilisin-like protease 3 0.0053 0.0854 1
Loa Loa (eye worm) endoprotease bli-4 0.0053 0.0854 0.0854
Plasmodium falciparum subtilisin-like protease 1 0.0053 0.0854 1
Echinococcus granulosus tumor protein p63 0.0331 0.9248 0.9234
Loa Loa (eye worm) hypothetical protein 0.0053 0.0854 0.0854
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0854 0.5
Schistosoma mansoni hypothetical protein 0.0164 0.4196 0.4088
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0053 0.0854 0.0684
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0592 0.0417
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0053 0.0854 0.0684
Leishmania major subtilisin-like serine peptidase 0.0053 0.0854 1
Trypanosoma brucei serine peptidase, clan SB, family S8-like protein 0.0053 0.0854 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Echinococcus granulosus peptidase s8 s53 subtilisin kexin sedolisin 0.0053 0.0854 0.0684
Echinococcus granulosus furin 0.0053 0.0854 0.0684
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0592 0.0417
Trypanosoma brucei subtilisin peptidase 0.0053 0.0854 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0592 0.0417
Echinococcus granulosus membrane bound transcription factor site 1 0.0356 1 1
Brugia malayi endoprotease bli-4 precursor 0.0053 0.0854 0.0854
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0854 0.5
Toxoplasma gondii subtilisin SUB10 0.0053 0.0854 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0097 0.2186 0.2186
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Onchocerca volvulus 0.0356 1 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0053 0.0854 0.5
Echinococcus multilocularis Peptidase S8 S53, subtilisin kexin sedolisin 0.0053 0.0854 0.0684

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) 0 Inhibition of rabbit muscle GPa ChEMBL. 17719791

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

1 literature reference was collected for this gene.

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