Detailed information for compound 1284715

Basic information

Technical information
  • TDR Targets ID: 1284715
  • Name: 3-(1-phenyltetrazol-5-yl)pyridine
  • MW: 223.233 | Formula: C12H9N5
  • H donors: 0 H acceptors: 4 LogP: 1.82 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1ccc(cc1)n1nnnc1c1cccnc1
  • InChi: 1S/C12H9N5/c1-2-6-11(7-3-1)17-12(14-15-16-17)10-5-4-8-13-9-10/h1-9H
  • InChiKey: VEAVOIQJULKVHR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(1-phenyl-5-tetrazolyl)pyridine
  • 3-(1-phenyl-1,2,3,4-tetrazol-5-yl)pyridine
  • 3-(1-Phenyl-1H-tetrazol-5-yl)-pyridine
  • ASN 09130256
  • MLS000707425
  • SMR000288890
  • ZINC04985590

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis tumor protein p63 0.0327 0.4881 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0511 0.7866 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0102 0.124 0.435
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0051 0.0416 0.1437
Mycobacterium ulcerans flavoprotein disulfide reductase 0.007 0.0717 0.5
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.007 0.0717 0.1455
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.046 0.7035 0.8837
Schistosoma mansoni hypothetical protein 0.0032 0.0109 0.0101
Entamoeba histolytica hypothetical protein 0.0037 0.019 0.5
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.007 0.0717 0.071
Treponema pallidum NADH oxidase 0.007 0.0717 0.5
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0109 0.0355
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0109 0.0207
Echinococcus granulosus thioredoxin glutathione reductase 0.0202 0.2851 0.5834
Plasmodium falciparum glutathione reductase 0.007 0.0717 0.2304
Loa Loa (eye worm) hypothetical protein 0.0032 0.0109 0.0381
Brugia malayi latrophilin 2 splice variant baaae 0.007 0.0717 0.2493
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.007 0.0717 0.2304
Plasmodium falciparum thioredoxin reductase 0.0202 0.2851 1
Trypanosoma cruzi trypanothione reductase, putative 0.007 0.0717 0.2304
Loa Loa (eye worm) hypothetical protein 0.007 0.0717 0.2513
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0511 0.7866 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0008 0.0027
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.019 0.0374
Loa Loa (eye worm) hypothetical protein 0.0102 0.124 0.435
Plasmodium vivax thioredoxin reductase, putative 0.0202 0.2851 1
Schistosoma mansoni hypothetical protein 0.0037 0.019 0.0182
Mycobacterium tuberculosis Probable dehydrogenase 0.046 0.7035 0.8837
Brugia malayi Calcitonin receptor-like protein seb-1 0.0102 0.124 0.4335
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.0717 0.2304
Loa Loa (eye worm) hypothetical protein 0.0026 0.0008 0.0027
Entamoeba histolytica hypothetical protein 0.0037 0.019 0.5
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Plasmodium falciparum thioredoxin reductase 0.007 0.0717 0.2304
Loa Loa (eye worm) hypothetical protein 0.0048 0.036 0.1264
Plasmodium falciparum glutathione reductase 0.0202 0.2851 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.046 0.7035 0.8837
Echinococcus multilocularis GPCR, family 2 0.0032 0.0109 0.0207
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.007 0.0717 0.2304
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0109 0.0207
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.007 0.0717 0.2304
Echinococcus granulosus tumor protein p63 0.0327 0.4881 1
Loa Loa (eye worm) glutathione reductase 0.0202 0.2851 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0202 0.2851 0.2985
Trypanosoma brucei trypanothione reductase 0.0202 0.2851 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0511 0.7866 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Toxoplasma gondii NADPH-glutathione reductase 0.007 0.0717 0.2304
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.046 0.7035 0.8837
Trichomonas vaginalis mercuric reductase, putative 0.007 0.0717 0.5
Echinococcus granulosus GPCR family 2 0.0032 0.0109 0.0207
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Brugia malayi Thioredoxin reductase 0.0202 0.2851 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.007 0.0717 0.1455
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0109 0.0207
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.007 0.0717 0.2304
Giardia lamblia NADH oxidase lateral transfer candidate 0.007 0.0717 0.5
Entamoeba histolytica hypothetical protein 0.0037 0.019 0.5
Trypanosoma cruzi trypanothione reductase, putative 0.0202 0.2851 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Schistosoma mansoni hypothetical protein 0.0032 0.0109 0.0101
Echinococcus multilocularis thioredoxin glutathione reductase 0.0202 0.2851 0.5834
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.007 0.0717 0.5
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0008 0.0027
Brugia malayi hypothetical protein 0.0037 0.019 0.0641
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0051 0.0416 0.1437
Loa Loa (eye worm) thioredoxin reductase 0.0202 0.2851 1
Brugia malayi hypothetical protein 0.003 0.0078 0.0247
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.007 0.0717 0.2304
Schistosoma mansoni hypothetical protein 0.0032 0.0109 0.0101
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.007 0.0717 0.5
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.007 0.0717 0.2304
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.046 0.7035 0.8837
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.0717 0.5
Brugia malayi glutathione reductase 0.0202 0.2851 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0109 0.0355
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.0717 0.5
Mycobacterium tuberculosis Probable reductase 0.046 0.7035 0.8837
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0109 0.0207
Leishmania major acetoin dehydrogenase e3 component-like protein 0.007 0.0717 0.2304
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0511 0.7866 1
Leishmania major trypanothione reductase 0.0202 0.2851 1
Onchocerca volvulus 0.0048 0.036 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.019 0.0374
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.007 0.0717 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0109 0.0381
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Plasmodium vivax glutathione reductase, putative 0.0202 0.2851 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.0717 0.2304
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Entamoeba histolytica hypothetical protein 0.0037 0.019 0.5
Loa Loa (eye worm) hypothetical protein 0.003 0.0078 0.0273
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.0717 0.2304
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.019 0.0182
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.007 0.0717 0.2494
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.036 0.0353
Toxoplasma gondii thioredoxin reductase 0.0202 0.2851 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0102 0.124 0.4335
Trichomonas vaginalis glutathione reductase, putative 0.007 0.0717 0.5
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.0717 0.2304
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.0717 0.2304
Schistosoma mansoni hypothetical protein 0.0032 0.0109 0.0101
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.007 0.0717 0.2304
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.007 0.0717 0.2304
Schistosoma mansoni hypothetical protein 0.007 0.0717 0.0709

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.7783 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.9811 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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