Detailed information for compound 1331918

Basic information

Technical information
  • TDR Targets ID: 1331918
  • Name: 2-phenylimidazo[3,2-a]pyridine-3-carbaldehyde
  • MW: 222.242 | Formula: C14H10N2O
  • H donors: 0 H acceptors: 2 LogP: 3.22 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=Cc1c(nc2n1cccc2)c1ccccc1
  • InChi: 1S/C14H10N2O/c17-10-12-14(11-6-2-1-3-7-11)15-13-8-4-5-9-16(12)13/h1-10H
  • InChiKey: GDQWGRMPXASNTI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-phenyl-3-imidazo[3,2-a]pyridinecarboxaldehyde
  • 3672-39-7
  • Oprea1_407423
  • ZINC00337535
  • AQ-776/13771641
  • Imidazo[1,2-a]pyridine-3-carboxaldehyde, 2-phenyl-
  • 2-phenylimidazo[1,2-a]pyridine-3-carbaldehyde
  • TOS-BB-0587
  • GL-0633
  • MLS001001940
  • SMR000353279
  • ST5121734

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
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
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.2105 0.2407
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0949 0.5
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0423 0.0484
Entamoeba histolytica hypothetical protein 0.0038 0.1217 0.5
Loa Loa (eye worm) TAR-binding protein 0.0139 0.5325 0.6091
Loa Loa (eye worm) hypothetical protein 0.0019 0.0423 0.0484
Trichomonas vaginalis set domain proteins, putative 0.0253 1 0.5
Echinococcus granulosus GPCR family 2 0.0019 0.0423 0.0794
Schistosoma mansoni tar DNA-binding protein 0.0139 0.5325 1
Schistosoma mansoni hypothetical protein 0.0019 0.0423 0.0794
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.1217 0.2286
Echinococcus multilocularis tar DNA binding protein 0.0139 0.5325 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0128 0.4864 0.5563
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0423 0.0794
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0949 0.1783
Schistosoma mansoni tar DNA-binding protein 0.0139 0.5325 1
Entamoeba histolytica hypothetical protein 0.0038 0.1217 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0423 0.0484
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0032 0.0949 0.1783
Brugia malayi RNA recognition motif domain containing protein 0.0139 0.5325 0.6091
Entamoeba histolytica hypothetical protein 0.0038 0.1217 0.5
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0949 0.1783
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.1217 0.2286
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0423 0.0794
Brugia malayi hypothetical protein 0.0038 0.1217 0.1392
Loa Loa (eye worm) hypothetical protein 0.0032 0.0949 0.1086
Schistosoma mansoni hypothetical protein 0.0019 0.0423 0.0794
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0423 0.0794
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0139 0.5325 0.6091
Loa Loa (eye worm) RNA binding protein 0.0139 0.5325 0.6091
Brugia malayi Pre-SET motif family protein 0.0223 0.8743 1
Schistosoma mansoni tar DNA-binding protein 0.0139 0.5325 1
Brugia malayi MH2 domain containing protein 0.0128 0.4864 0.5563
Entamoeba histolytica hypothetical protein 0.0038 0.1217 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.1326 0.1517
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0223 0.8743 1
Loa Loa (eye worm) hypothetical protein 0.006 0.2105 0.2407
Schistosoma mansoni hypothetical protein 0.0038 0.1217 0.2286
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0949 0.1783
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0949 0.1783
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0032 0.0949 0.1783
Schistosoma mansoni tar DNA-binding protein 0.0139 0.5325 1
Echinococcus multilocularis GPCR, family 2 0.0019 0.0423 0.0794
Brugia malayi TAR-binding protein 0.0139 0.5325 0.6091
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0901 0.1693
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.1217 0.2286
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.2105 0.2407
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0423 0.0794
Schistosoma mansoni hypothetical protein 0.0019 0.0423 0.0794
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.2105 0.2407
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0423 0.0484
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0949 0.1783
Loa Loa (eye worm) transcription factor SMAD2 0.0128 0.4864 0.5563
Schistosoma mansoni hypothetical protein 0.0041 0.1326 0.249
Plasmodium vivax SET domain protein, putative 0.0032 0.0949 0.5
Brugia malayi RNA binding protein 0.0139 0.5325 0.6091
Schistosoma mansoni hypothetical protein 0.0019 0.0423 0.0794
Echinococcus granulosus tar DNA binding protein 0.0139 0.5325 1
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1326 0.1517
Brugia malayi Pre-SET motif family protein 0.0032 0.0949 0.1086
Schistosoma mansoni tar DNA-binding protein 0.0139 0.5325 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) > 300 um PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Identify Inhibitors of Mex-5 Binding to TCR-2. (Class of assay: confirmatory) [Related pubchem assays: 1833 (Project Summary), 1832 (Primary HTS)] ChEMBL. No reference
EC50 (binding) > 300 um PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Identify Inhibitors of POS-1 Binding to mex-3-RNA. (Class of assay: confirmatory) [Related pubchem assays: 1833 (Project Summary), 1832 (Primary HTS)] ChEMBL. No reference
IC50 (functional) 155.089 uM PubChem BioAssay. Absorbance-based biochemical high throughput dose response assay to identify inhibitors of Methionine sulfoxide reductase A (MsrA). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 13.1154 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) 14.1254 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 37.933 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.