Detailed information for compound 919270

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 308.331 | Formula: C18H16N2O3
  • H donors: 1 H acceptors: 1 LogP: 3.24 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc2c(c1)OC(=C([C@@H]2c1cccc(c1)OC)C#N)N
  • InChi: 1S/C18H16N2O3/c1-21-12-5-3-4-11(8-12)17-14-7-6-13(22-2)9-16(14)23-18(20)15(17)10-19/h3-9,17H,20H2,1-2H3/t17-/m1/s1
  • InChiKey: WKLKYONGSSJYLW-QGZVFWFLSA-N  

Network

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Synonyms

No synonyms found for this compound

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) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Echinococcus multilocularis G protein coupled receptor 139 0.1366 1 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.1366 1 1
Loa Loa (eye worm) serotonin transporter b 0.0478 0.0958 0.0958
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Echinococcus multilocularis orexin receptor type 2 0.1366 1 1
Schistosoma mansoni neuropeptide f receptor 76f 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni biogenic amine receptor 0.1366 1 1
Schistosoma mansoni adenoreceptor 0.1366 1 1
Brugia malayi larval opioid receptor 0.1366 1 1
Brugia malayi G protein-coupled receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus serotonin receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Brugia malayi Melatonin receptor type 1A 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.1366 1 1
Schistosoma mansoni neuropeptide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni biogenic amine receptor 0.1366 1 1
Echinococcus multilocularis fmrfamide receptor 0.1366 1 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Brugia malayi AKH receptor 0.1366 1 1
Treponema pallidum sodium- and chloride- dependent transporter 0.0478 0.0958 0.5
Brugia malayi putative neuropeptide receptor NPR1 0.1366 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1366 1 1
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.1366 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.1366 1 1
Schistosoma mansoni histamine h1 receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni amine GPCR 0.1366 1 1
Echinococcus multilocularis neuropeptide s receptor 0.1366 1 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.1366 1 1
Brugia malayi putative neuropeptide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Echinococcus granulosus sex peptide receptor 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Brugia malayi Dopamine receptor protein 1 0.1366 1 1
Echinococcus granulosus neuropeptides capa receptor 0.1366 1 1
Echinococcus granulosus neuropeptide FF receptor 2 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus multilocularis allatostatin A receptor 0.1366 1 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.1366 1 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Echinococcus granulosus neuropeptide receptor A26 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi G-protein coupled receptor 0.1366 1 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.1366 1 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Loa Loa (eye worm) TYRA-2 protein 0.1366 1 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.1366 1 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0478 0.0958 0.0958
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.1366 1 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.1366 1 1
Echinococcus multilocularis serotonin receptor 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Schistosoma mansoni hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni hypothetical protein 0.1366 1 1
Schistosoma mansoni neuropeptide receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.1366 1 1
Echinococcus granulosus allatostatin A receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Echinococcus multilocularis neuropeptide receptor A26 0.1366 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1366 1 1
Echinococcus multilocularis g protein coupled receptor 0.1366 1 1
Brugia malayi neuropeptide F receptor 0.1366 1 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.1366 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.1366 1 1
Schistosoma mansoni neuropeptide receptor 0.1366 1 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.1366 1 1
Echinococcus granulosus g protein coupled receptor 0.1366 1 1
Echinococcus granulosus neuropeptide receptor 0.1366 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.1366 1 1
Echinococcus granulosus neuropeptide s receptor 0.1366 1 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.1366 1 1
Schistosoma mansoni amine GPCR 0.1366 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.1366 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.1366 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) solute carrier family 6 member 4 0.0478 0.0958 0.0958
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Loa Loa (eye worm) melatonin receptor type 1A 0.1366 1 1
Brugia malayi GnHR receptor homolog 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.0478 0.0958 0.0958
Echinococcus multilocularis dro:myosuppressin receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.1366 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Echinococcus granulosus neuropeptide Y receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.0478 0.0958 0.0958
Onchocerca volvulus Neuropeptide F receptor homolog 0.1366 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.1366 1 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.1366 1 1
Echinococcus multilocularis g protein coupled receptor 0.1366 1 1
Loa Loa (eye worm) norepinephrine transporter 0.0478 0.0958 0.0958
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus somatostatin receptor 0.1366 1 1
Leishmania major C-8 sterol isomerase-like protein 0.0384 0 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Brugia malayi Dopamine receptor 0.1366 1 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.1366 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.1366 1 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.1366 1 1
Schistosoma mansoni biogenic amine receptor 0.1366 1 1
Brugia malayi Dopamine receptor protein 2 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus neuropeptide Y receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Echinococcus multilocularis neuropeptide receptor 0.1366 1 1
Brugia malayi follicle stimulating hormone receptor 0.1366 1 1
Echinococcus granulosus orexin receptor type 2 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.1366 1 1
Brugia malayi ORL1-like opioid receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus neuropeptides capa receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Echinococcus granulosus hypothetical protein 0.1366 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1366 1 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni hypothetical protein 0.1366 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.1366 1 1
Schistosoma mansoni hypothetical protein 0.1366 1 1
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0384 0 0.5
Schistosoma mansoni myosin xvIII 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Mycobacterium tuberculosis Secreted antigen 85-C FbpC (85C) (antigen 85 complex C) (AG58C) (mycolyl transferase 85C) (fibronectin-binding protein C) 0.0891 0.516 0.5
Echinococcus granulosus g protein coupled receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.0478 0.0958 0.0958
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.1366 1 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.1366 1 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.1366 1 1
Schistosoma mansoni opsin-like receptor 0.1366 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus granulosus dro:myosuppressin receptor 0.1366 1 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.1366 1 1
Echinococcus multilocularis serotonin receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Mycobacterium ulcerans secreted antigen 85-C FbpC 0.0891 0.516 0.5
Schistosoma mansoni amine GPCR 0.1366 1 1
Brugia malayi G protein-coupled receptor F59B2.13 0.1366 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.1366 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.1366 1 1
Brugia malayi RE15519p 0.1366 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.1366 1 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Trypanosoma brucei C-8 sterol isomerase, putative 0.0384 0 0.5
Echinococcus multilocularis sex peptide receptor 0.1366 1 1
Echinococcus multilocularis g-protein coupled receptor 0.1366 1 1
Schistosoma mansoni neuropeptide receptor 0.1366 1 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.1366 1 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.1366 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus multilocularis neuropeptide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.1366 1 1
Echinococcus granulosus G protein coupled receptor 139 0.1366 1 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.1366 1 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.1366 1 1
Echinococcus granulosus fmrfamide receptor 0.1366 1 1
Echinococcus multilocularis fmrfamide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.1366 1 1
Brugia malayi neuropeptide F receptor 0.1366 1 1
Echinococcus granulosus neuropeptide receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Echinococcus multilocularis somatostatin receptor 0.1366 1 1
Brugia malayi G-protein coupled receptor 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Schistosoma mansoni opsin-like receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi sulfakinin receptor protein 0.1366 1 1
Echinococcus granulosus g-protein coupled receptor 0.1366 1 1
Brugia malayi Serotonin receptor 0.1366 1 1
Onchocerca volvulus 0.1366 1 1
Echinococcus granulosus 7tm_1 domain containing protein 0.1366 1 1
Schistosoma mansoni growth hormone secretagogue receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Mycobacterium leprae SECRETED ANTIGEN 85-C FBPC (85C) (ANTIGEN 85 COMPLEX C) (AG58C) (MYCOLYL TRANSFERASE 85C) (FIBRONECTIN-BINDING PROTEIN C) 0.0891 0.516 0.5
Echinococcus multilocularis g protein coupled receptor 0.1366 1 1
Schistosoma mansoni amine GPCR 0.1366 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.1366 1 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.1366 1 1
Echinococcus granulosus g protein coupled receptor 0.1366 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.1366 1 1
Brugia malayi Serotonin receptor 0.1366 1 1
Schistosoma mansoni opsin-like receptor 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Loa Loa (eye worm) hypothetical protein 0.1366 1 1
Brugia malayi hypothetical protein 0.1366 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.1366 1 1
Schistosoma mansoni amine GPCR 0.1366 1 1
Onchocerca volvulus 0.1366 1 1

Activities

No activities found for this compound.

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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