Detailed information for compound 912767

Basic information

Technical information
  • TDR Targets ID: 912767
  • Name: N-(1,3-thiazol-2-yl)-5,6,7,8-tetrahydronaphth alene-2-carboxamide
  • MW: 258.339 | Formula: C14H14N2OS
  • H donors: 1 H acceptors: 2 LogP: 3.5 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc2c(c1)CCCC2)Nc1nccs1
  • InChi: 1S/C14H14N2OS/c17-13(16-14-15-7-8-18-14)12-6-5-10-3-1-2-4-11(10)9-12/h5-9H,1-4H2,(H,15,16,17)
  • InChiKey: NHGPNWOCGATKJL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-thiazol-2-yltetralin-6-carboxamide
  • N-(2-thiazolyl)-6-tetralincarboxamide
  • ZINC04088443
  • IFLab1_002201
  • Oprea1_324124

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
Loa Loa (eye worm) TAR-binding protein 0.0063 0.8374 0.9042
Mycobacterium ulcerans hypothetical protein 0.0024 0.1293 1
Schistosoma mansoni tar DNA-binding protein 0.0063 0.8374 1
Onchocerca volvulus 0.0024 0.1293 0.5
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.156 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0222 0.024
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.1293 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.1293 0.1396
Loa Loa (eye worm) hypothetical protein 0.0018 0.0222 0.024
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0222 0.139
Echinococcus multilocularis zinc finger protein 0.0019 0.0435 0.052
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.1293 0.5
Schistosoma mansoni tar DNA-binding protein 0.0063 0.8374 1
Brugia malayi hypothetical protein 0.0025 0.156 0.0307
Loa Loa (eye worm) hypothetical protein 0.0018 0.0222 0.024
Loa Loa (eye worm) hypothetical protein 0.0037 0.3679 0.3972
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.1293 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.156 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.4087 0.4413
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.1293 0.5
Loa Loa (eye worm) hypothetical protein 0.0024 0.1293 0.1396
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0618 0.0667
Loa Loa (eye worm) hypothetical protein 0.0068 0.9262 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.1293 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.1293 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.1293 1
Schistosoma mansoni tar DNA-binding protein 0.0063 0.8374 1
Brugia malayi PHD-finger family protein 0.0024 0.1356 0.0073
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0947 0.1131
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.1293 0.5
Schistosoma mansoni hypothetical protein 0.002 0.0618 0.0738
Brugia malayi RNA binding protein 0.0063 0.8374 0.8133
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.8374 0.9042
Echinococcus granulosus tar DNA binding protein 0.0063 0.8374 1
Brugia malayi Bromodomain containing protein 0.0037 0.3667 0.2726
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.8374 0.8133
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.156 0.5
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.3258 0.389
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0947 0.1131
Loa Loa (eye worm) hypothetical protein 0.0025 0.156 0.1685
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.156 0.5
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.736 0.8788
Schistosoma mansoni bromodomain containing protein 0.0061 0.7978 0.9526
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0222 0.5
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.1293 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.156 0.5
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.1293 0.5
Echinococcus granulosus zinc finger protein 0.0019 0.0435 0.052
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.1293 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.0222 0.024
Leishmania major hypothetical protein, conserved 0.0025 0.156 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.156 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.1293 0.1396
Echinococcus multilocularis tar DNA binding protein 0.0063 0.8374 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.156 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.4417 0.4769
Schistosoma mansoni tar DNA-binding protein 0.0063 0.8374 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.1293 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0222 0.024
Schistosoma mansoni tar DNA-binding protein 0.0063 0.8374 1
Brugia malayi TAR-binding protein 0.0063 0.8374 0.8133
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0106 0.0114
Schistosoma mansoni zinc finger protein 0.0019 0.0435 0.052
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.1293 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0947 0.1131
Loa Loa (eye worm) RNA binding protein 0.0063 0.8374 0.9042
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.736 0.8788
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.3258 0.389
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.1293 1

Activities

Activity type Activity value Assay description Source Reference
(functional) > 7.75 ug/ml In vitro cytotoxicity evaluation on human fibroblasts measured by fluorescence after 72h WHO/TDR. No reference
% motility reduction (functional) = 0 % Motility reduction assay in Schistosoma mansoni Puerto Rican adult worms WHO/TDR. No reference
% motility reduction (functional) = 0 % Motility reduction assay in Onchocerca lienalis microfilariae WHO/TDR. No reference
% motility reduction (functional) = 25 % Motility Reduction against Brugia malayi adult worms at 10 uM WHO/TDR. No reference
% motility reduction (functional) = 100 % Motility reduction assay in vitro against Brugia malayi microfilariae at 10 uM WHO/TDR. No reference
IC50 (functional) > 7.75 ug/ml In vitro activity against Plasmodium falciparum measured by colorimetry after 72h WHO/TDR. No reference
IC50 (functional) > 7.75 ug/ml In vitro activity against Trypanosoma cruzi in human lung fibroblast measured by colorimetry after 7 days WHO/TDR. No reference
IC50 (functional) > 7.75 ug/ml In vitro activity against Trypanosoma brucei measured by florescence after 24h WHO/TDR. No reference
IC50 (functional) > 7.75 ug/ml In vitro activity against Leishmania infantum in mouse macrophages measured by cell viability after 5 days WHO/TDR. No reference
IC50 > 7.75 ug/ml WHO-TDR: Cytotoxicity ChEMBL. No reference
IC50 (functional) > 7.75 ug/ml WHO-TDR: Chagas disease ChEMBL. No reference
IC50 (functional) > 7.75 ug/ml WHO-TDR: Leishmaniasis ChEMBL. No reference
IC50 (functional) > 7.75 ug/ml WHO-TDR: Human African Trypanosomiasis (HAT) ChEMBL. No reference
IC50 (functional) > 7.75 ug/ml WHO-TDR: Malaria ChEMBL. No reference
IC50 (functional) = 5.185 uM Anti Brugia malayi microfilariae activity in vitro WHO/TDR. No reference
IC50 (functional) = 5.185 uM WHO-TDR: Lymphatic Filariasis ChEMBL. No reference
Inhibition (functional) = 0 % WHO-TDR: Schistosomiasis ChEMBL. No reference
Inhibition (functional) = 25 % WHO-TDR: Lymphatic Filariasis ChEMBL. No reference
Inhibition (functional) = 100 % WHO-TDR: Lymphatic Filariasis ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Leishmania infantum ChEMBL23
Trypanosoma cruzi ChEMBL23
Plasmodium falciparum
Trypanosoma brucei gambiense
Homo sapiens ChEMBL23
Brugia malayi ChEMBL23

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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