Detailed information for compound 1456299

Basic information

Technical information
  • TDR Targets ID: 1456299
  • Name: (5-methylfuran-2-yl)-pyridin-3-ylmethanol
  • MW: 189.211 | Formula: C11H11NO2
  • H donors: 1 H acceptors: 2 LogP: 1.16 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(o1)C(c1cccnc1)O
  • InChi: 1S/C11H11NO2/c1-8-4-5-10(14-8)11(13)9-3-2-6-12-7-9/h2-7,11,13H,1H3
  • InChiKey: IAJIUQPRKJRSLJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (5-methyl-2-furyl)-(3-pyridyl)methanol
  • (5-methylfuran-2-yl)-pyridin-3-yl-methanol
  • ST034586
  • Oprea1_032002
  • ChemDiv3_002881
  • (5-Methyl-furan-2-yl)-pyridin-3-yl-methanol
  • MLS000029488
  • SMR000011696
  • Oprea1_360697
  • ARONIS001839
  • BAS 02985206

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni smad 0.0033 0.0189 0.0189
Toxoplasma gondii LsmAD domain-containing protein 0.0078 0.0835 1
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.003 0.0141 0.0141
Brugia malayi Smad1 0.0033 0.0189 0.0189
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.003 0.0141 0.0141
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.003 0.0141 0.0141
Loa Loa (eye worm) heterotrimeric G protein alpha subunit 0.003 0.0141 0.0141
Echinococcus granulosus guanine nucleotide binding protein subunit 0.003 0.0141 0.0141
Trichomonas vaginalis GTP-binding protein (z) alpha subunit, gnaz, putative 0.003 0.0141 0.0359
Plasmodium falciparum ataxin-2 like protein, putative 0.0078 0.0835 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0084 0.0927 0.0927
Brugia malayi guanine nucleotide-binding protein G(o), alpha subunit, putative 0.003 0.0141 0.0141
Echinococcus granulosus TGF beta signal transducer SmadC 0.0033 0.0189 0.0189
Mycobacterium leprae PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+]) 0.0021 0 0.5
Brugia malayi RNA binding protein 0.0199 0.2609 0.2609
Brugia malayi guanine nucleotide-binding protein alpha-7 subunit, putative 0.003 0.0141 0.0141
Echinococcus multilocularis Smad4 0.0033 0.0189 0.0189
Brugia malayi Guanine nucleotide-binding protein alpha-12 subunit, putative 0.003 0.0141 0.0141
Brugia malayi latrophilin 2 splice variant baaae 0.0181 0.2353 0.2353
Trichomonas vaginalis GTP-binding protein alpha subunit, gna, putative 0.003 0.0141 0.0359
Schistosoma mansoni smad1 5 8 and 0.0033 0.0189 0.0189
Brugia malayi MH2 domain containing protein 0.0491 0.6891 0.6891
Echinococcus multilocularis GPCR, family 2 0.0084 0.0927 0.0927
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0703 1 1
Schistosoma mansoni hypothetical protein 0.0084 0.0927 0.0927
Brugia malayi hypothetical protein 0.005 0.0432 0.0432
Schistosoma mansoni GTP-binding protein (I) alpha subunit gnai 0.003 0.0141 0.0141
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0084 0.0927 0.0927
Schistosoma mansoni hypothetical protein 0.0035 0.0208 0.0208
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-12 subunit 0.003 0.0141 0.0141
Schistosoma mansoni Smad4 0.0033 0.0189 0.0189
Brugia malayi MH1 domain containing protein 0.0033 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.003 0.0141 0.0141
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0084 0.0927 0.0927
Trichomonas vaginalis GTP-binding protein (q) alpha-11 subunit, gna11, putative 0.003 0.0141 0.0359
Treponema pallidum DNA ligase (lig) 0.0021 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2609 0.2609
Brugia malayi hypothetical protein 0.003 0.0141 0.0141
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0703 1 1
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.003 0.0141 0.0141
Schistosoma mansoni hypothetical protein 0.0084 0.0927 0.0927
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.0021 0 0.5
Schistosoma mansoni hypothetical protein 0.0084 0.0927 0.0927
Brugia malayi Calcitonin receptor-like protein seb-1 0.0265 0.3582 0.3582
Echinococcus granulosus tar DNA binding protein 0.0199 0.2609 0.2609
Brugia malayi MH1 domain containing protein 0.0033 0.0189 0.0189
Loa Loa (eye worm) transcription factor SMAD2 0.0491 0.6891 0.6891
Brugia malayi MH2 domain containing protein 0.0033 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0181 0.2353 0.2353
Trypanosoma cruzi PAB1-binding protein , putative 0.0078 0.0835 1
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0405 0.5637 1
Trichomonas vaginalis G protein (olf) alpha subunit, gnal, putative 0.003 0.0141 0.0359
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.003 0.0141 0.0141
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0265 0.3582 0.3582
Echinococcus granulosus Smad4 0.0033 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.003 0.0141 0.0141
Schistosoma mansoni smad1 5 8 and 0.0033 0.0189 0.0189
Echinococcus granulosus GPCR family 2 0.0084 0.0927 0.0927
Brugia malayi guanine nucleotide-binding protein alpha-3 subunit, putative 0.003 0.0141 0.0141
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0703 1 1
Trypanosoma brucei PAB1-binding protein , putative 0.0078 0.0835 1
Loa Loa (eye worm) hypothetical protein 0.0265 0.3582 0.3582
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0703 1 1
Loa Loa (eye worm) hypothetical protein 0.0078 0.0835 0.0835
Echinococcus multilocularis smad 0.0033 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.003 0.0141 0.0141
Trichomonas vaginalis glutaminase, putative 0.0289 0.3931 1
Loa Loa (eye worm) G protein alpha subunit 3 0.003 0.0141 0.0141
Loa Loa (eye worm) GTP-binding regulatory protein alpha chain 0.003 0.0141 0.0141
Schistosoma mansoni glutaminase 0.0289 0.3931 0.3931
Echinococcus granulosus guanine nucleotide binding protein G protein 0.003 0.0141 0.0141
Brugia malayi Latrophilin receptor protein 2 0.0084 0.0927 0.0927
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-6 subunit 0.003 0.0141 0.0141
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0035 0.0208 0.0208
Mycobacterium ulcerans glutaminase 0.0289 0.3931 1
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2609 0.2609
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.003 0.0141 0.0141
Schistosoma mansoni hypothetical protein 0.0181 0.2353 0.2353
Brugia malayi Guanine nucleotide-binding protein alpha-6 subunit, putative 0.003 0.0141 0.0141
Schistosoma mansoni GTP-binding protein alpha subunit 0.003 0.0141 0.0141
Loa Loa (eye worm) RNA binding protein 0.0199 0.2609 0.2609
Loa Loa (eye worm) glutaminase 0.0289 0.3931 0.3931
Trichomonas vaginalis GTP-binding protein alpha subunit, gna, putative 0.003 0.0141 0.0359
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.003 0.0141 0.0141
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0703 1 1
Schistosoma mansoni trimeric G-protein alpha o subunit 0.003 0.0141 0.0141
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.003 0.0141 0.0141
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.003 0.0141 0.0141
Brugia malayi G-protein alpha subunit 0.003 0.0141 0.0141
Loa Loa (eye worm) latrophilin receptor protein 2 0.0084 0.0927 0.0927
Echinococcus multilocularis gtp binding protein (I) alpha 1subunit 0.003 0.0141 0.0141
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2609 0.2609
Loa Loa (eye worm) hypothetical protein 0.003 0.0141 0.0141
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2609 0.2609
Loa Loa (eye worm) hypothetical protein 0.003 0.0141 0.0141
Loa Loa (eye worm) MH1 domain-containing protein 0.0033 0.0189 0.0189
Schistosoma mansoni smad1 5 8 and 0.0033 0.0189 0.0189
Trypanosoma cruzi PAB1-binding protein , putative 0.0078 0.0835 1
Loa Loa (eye worm) Smad1 0.0033 0.0189 0.0189
Brugia malayi hypothetical protein 0.0078 0.0835 0.0835
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.003 0.0141 0.0141
Trichomonas vaginalis GTP-binding protein alpha subunit, gna, putative 0.003 0.0141 0.0359
Echinococcus granulosus guanine nucleotide binding protein G protein 0.003 0.0141 0.0141
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.003 0.0141 0.0141
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.003 0.0141 0.0141
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.003 0.0141 0.0141
Echinococcus granulosus expressed protein 0.003 0.0141 0.0141
Entamoeba histolytica G protein alpha subunit, putative 0.003 0.0141 1
Brugia malayi guanine nucleotide-binding protein G-o protein alpha subunit 0.003 0.0141 0.0141
Brugia malayi GTP-binding regulatory protein alpha chain - starfish, putative 0.003 0.0141 0.0141
Brugia malayi TAR-binding protein 0.0199 0.2609 0.2609
Echinococcus granulosus smad 0.0033 0.0189 0.0189
Plasmodium vivax ataxin-2 like protein, putative 0.0078 0.0835 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0033 0.0189 0.0189
Leishmania major hypothetical protein, conserved 0.0078 0.0835 0.5
Trichomonas vaginalis GTP-binding protein alpha subunit, gna, putative 0.003 0.0141 0.0359
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0033 0.0189 0.0189
Echinococcus multilocularis expressed protein 0.003 0.0141 0.0141
Echinococcus multilocularis tar DNA binding protein 0.0199 0.2609 0.2609
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0703 1 1
Brugia malayi glutaminase DH11.1 0.0289 0.3931 0.3931
Trichomonas vaginalis GTP-binding protein (O) alpha subunit, gnao, putative 0.003 0.0141 0.0359
Loa Loa (eye worm) hypothetical protein 0.0084 0.0927 0.0927
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0199 0.2609 0.2609
Loa Loa (eye worm) hypothetical protein 0.0405 0.5637 0.5637
Echinococcus multilocularis mothers against decapentaplegic 5 0.0033 0.0189 0.0189
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0703 1 1
Echinococcus granulosus gtp binding protein I alpha 1subunit 0.003 0.0141 0.0141
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0035 0.0208 0.0208
Schistosoma mansoni GTP-binding protein alpha subunit 0.003 0.0141 0.0141
Onchocerca volvulus 0.003 0.0141 0.025
Plasmodium falciparum ataxin-2 like protein, putative 0.0078 0.0835 1
Loa Loa (eye worm) glutaminase 2 0.0289 0.3931 0.3931
Schistosoma mansoni hypothetical protein 0.0084 0.0927 0.0927
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0084 0.0927 0.0927
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0084 0.0927 0.0927
Echinococcus granulosus mothers against decapentaplegic 5 0.0033 0.0189 0.0189
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0703 1 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0033 0.0189 0.0189
Echinococcus granulosus guanine nucleotide binding protein subunit 0.003 0.0141 0.0141
Brugia malayi N-terminal motif family protein 0.0405 0.5637 0.5637
Giardia lamblia Replication factor C, subunit 1 0.0021 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0199 0.2609 0.2609
Loa Loa (eye worm) MH2 domain-containing protein 0.0491 0.6891 0.6891
Onchocerca volvulus 0.003 0.0141 0.025
Brugia malayi MH2 domain containing protein 0.0033 0.0189 0.0189
Brugia malayi RNA recognition motif domain containing protein 0.0199 0.2609 0.2609
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0265 0.3582 0.3582
Loa Loa (eye worm) TAR-binding protein 0.0199 0.2609 0.2609
Chlamydia trachomatis DNA ligase 0.0021 0 0.5
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.003 0.0141 0.0141
Onchocerca volvulus 0.003 0.0141 0.025
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.003 0.0141 0.0141

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference

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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