Detailed information for compound 1811290

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 387.38 | Formula: C20H19F2N3O3
  • H donors: 2 H acceptors: 2 LogP: 4.43 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(cc1)/C=N/OC1CCCC1)NC(=O)c1c(F)cccc1F
  • InChi: 1S/C20H19F2N3O3/c21-16-6-3-7-17(22)18(16)19(26)25-20(27)24-14-10-8-13(9-11-14)12-23-28-15-4-1-2-5-15/h3,6-12,15H,1-2,4-5H2,(H2,24,25,26,27)/b23-12+
  • InChiKey: LAHRDICYIYBEPB-FSJBWODESA-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) G-protein-linked acetylcholine receptor protein 2 0.007 0.0325 0.0056
Echinococcus multilocularis neuroendocrine convertase 2 0.018 0.275 0.2549
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus sex peptide receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus fmrfamide receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis g-protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni neuropeptide F-like receptor 0.007 0.0325 0.0636
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Schistosoma mansoni hypothetical protein 0.007 0.0325 0.0636
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus multilocularis fmrfamide receptor 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.007 0.0325 0.0056
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.007 0.0325 0.0636
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Schistosoma mansoni opsin-like receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus granulosus tm gpcr rhodopsin 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus multilocularis G protein coupled receptor 139 0.007 0.0325 0.0056
Schistosoma mansoni neuropeptide receptor 0.007 0.0325 0.0636
Echinococcus granulosus thyrotropin releasing hormone receptor 0.007 0.0325 0.0056
Echinococcus granulosus neuropeptide receptor 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus multilocularis tachykinin peptides receptor 99D 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.0287 0.51 0.4964
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis serotonin receptor 0.007 0.0325 0.0056
Schistosoma mansoni neuropeptide F-like receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) G-protein coupled receptor 0.007 0.0325 0.0056
Echinococcus granulosus peptide allatostatin:somatostatin 0.007 0.0325 0.0056
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.007 0.0325 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.007 0.0325 0.0636
Schistosoma mansoni neuropeptide receptor 0.007 0.0325 0.0636
Schistosoma mansoni peptide (allatostatin)-like receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Brugia malayi proprotein convertase 2 0.018 0.275 0.2507
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus neuropeptide FF receptor 2 0.0509 1 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.007 0.0325 0.0056
Echinococcus granulosus dro:myosuppressin receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus allatostatin A receptor 0.007 0.0325 0.0056
Echinococcus multilocularis g protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0174 0.262 0.2415
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Echinococcus granulosus neuropeptide Y receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) G-protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni amine GPCR 0.007 0.0325 0.0636
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.007 0.0325 0.0636
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.007 0.0325 0.0056
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.007 0.0325 0.0056
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0174 0.262 1
Schistosoma mansoni neuropeptide f receptor 76f 0.007 0.0325 0.0636
Echinococcus multilocularis dro:myosuppressin receptor 0.007 0.0325 0.0056
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Echinococcus granulosus alpha 1A adrenergic receptor 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Schistosoma mansoni amine GPCR 0.007 0.0325 0.0636
Echinococcus multilocularis sex peptide receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptides capa receptor 0.007 0.0325 0.0056
Schistosoma mansoni neuropeptide receptor 0.007 0.0325 0.0636
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide FF receptor 2 0.0509 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide receptor 0.007 0.0325 0.0056
Echinococcus multilocularis biogenic amine (5HT) receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus biogenic amine 5HT receptor 0.007 0.0325 0.0056
Onchocerca volvulus Neuropeptide F receptor homolog 0.007 0.0325 0.5
Echinococcus multilocularis neuropeptide Y receptor 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide receptor A26 0.007 0.0325 0.0056
Brugia malayi neuroendocrine convertase 1 precursor 0.018 0.275 0.2507
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide s receptor 0.007 0.0325 0.0056
Schistosoma mansoni neuropeptide receptor 0.007 0.0325 0.0636
Schistosoma mansoni biogenic amine (dopamine) receptor 0.007 0.0325 0.0636
Schistosoma mansoni biogenic amine receptor 0.007 0.0325 0.0636
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus neuroendocrine convertase 2 0.018 0.275 0.2549
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.007 0.0325 0.0636
Echinococcus granulosus tm gpcr rhodopsin 0.007 0.0325 0.0056
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus granulosus orexin receptor type 2 0.007 0.0325 0.0056
Echinococcus multilocularis g protein coupled receptor 0.007 0.0325 0.0056
Echinococcus granulosus g protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) endoprotease bli-4 0.0287 0.51 0.4964
Onchocerca volvulus 0.007 0.0325 0.5
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.007 0.0325 0.0056
Echinococcus granulosus somatostatin receptor 0.007 0.0325 0.0056
Echinococcus multilocularis orexin receptor type 2 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Schistosoma mansoni biogenic amine receptor 0.007 0.0325 0.0636
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Schistosoma mansoni biogenic amine (5HT) receptor 0.007 0.0325 0.0636
Schistosoma mansoni amine GPCR 0.007 0.0325 0.0636
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0174 0.262 0.2415
Echinococcus multilocularis 0.0232 0.3877 0.3707
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus multilocularis somatostatin receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.0113 0.1257 0.1014
Echinococcus granulosus neuropeptides capa receptor 0.007 0.0325 0.0056
Echinococcus multilocularis fmrfamide receptor 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.007 0.0325 0.0636
Schistosoma mansoni myosin xvIII 0.007 0.0325 0.0636
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus tachykinin peptides receptor 99D 0.007 0.0325 0.0056
Echinococcus multilocularis G-protein coupled receptor, putative 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) melatonin receptor type 1A 0.007 0.0325 0.0056
Echinococcus granulosus neuropeptide Y receptor 0.007 0.0325 0.0056
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus serotonin receptor 0.007 0.0325 0.0056
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni alpha-1 adrenergic receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.007 0.0325 0.0056
Echinococcus multilocularis g protein coupled receptor 0.007 0.0325 0.0056
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.007 0.0325 0.0636
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0174 0.262 1
Schistosoma mansoni biogenic amine receptor 0.007 0.0325 0.0636
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.007 0.0325 0.0056
Schistosoma mansoni growth hormone secretagogue receptor 0.007 0.0325 0.0636
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0068 0.027 0.053
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.007 0.0325 0.0056
Schistosoma mansoni hypothetical protein 0.007 0.0325 0.0636
Echinococcus granulosus neuropeptide receptor 0.007 0.0325 0.0056
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Schistosoma mansoni opsin-like receptor 0.007 0.0325 0.0636
Schistosoma mansoni hypothetical protein 0.007 0.0325 0.0636
Giardia lamblia High cysteine membrane protein Group 2 0.0107 0.1126 1
Schistosoma mansoni histamine h1 receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.007 0.0325 0.0636
Echinococcus granulosus G protein coupled receptor 139 0.007 0.0325 0.0056
Echinococcus granulosus neuropeptides capa receptor 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Echinococcus multilocularis serotonin receptor 0.007 0.0325 0.0056
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni biogenic amine (dopamine) receptor 0.007 0.0325 0.0636
Echinococcus multilocularis allatostatin A receptor 0.007 0.0325 0.0056
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Echinococcus multilocularis alpha 1A adrenergic receptor 0.007 0.0325 0.0056
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.007 0.0325 0.0056
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.007 0.0325 0.0636
Echinococcus granulosus hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni biogenic amine (5HT) receptor 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide Y receptor 0.007 0.0325 0.0056
Schistosoma mansoni amine GPCR 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.007 0.0325 0.0056
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.007 0.0325 0.0056
Schistosoma mansoni furin-1 (S08 family) 0.0125 0.1527 0.2995
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) follicle stimulating hormone receptor 0.007 0.0325 0.0056
Brugia malayi endoprotease bli-4 precursor 0.0287 0.51 0.4935
Schistosoma mansoni adenoreceptor 0.007 0.0325 0.0636
Loa Loa (eye worm) TYRA-2 protein 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Echinococcus granulosus rhodopsin orphan GPCR 0.007 0.0325 0.0056
Onchocerca volvulus 0.007 0.0325 0.5
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Echinococcus granulosus neuropeptide s receptor 0.007 0.0325 0.0056
Echinococcus granulosus furin 0.0287 0.51 0.4964
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0287 0.51 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.007 0.0325 0.0056
Echinococcus granulosus tm gpcr rhodopsin 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.007 0.0325 0.0636
Echinococcus granulosus g protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.0509 1 1
Echinococcus granulosus 7tm_1 domain containing protein 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus granulosus g protein coupled receptor 0.007 0.0325 0.0056
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.007 0.0325 0.0056
Brugia malayi celfurPC protein 0.0232 0.3877 0.3671
Echinococcus granulosus neuropeptide receptor A26 0.007 0.0325 0.0056
Schistosoma mansoni hypothetical protein 0.007 0.0325 0.0636
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.007 0.0325 0.0636
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0068 0.027 0.1032
Echinococcus granulosus g-protein coupled receptor 0.007 0.0325 0.0056
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Schistosoma mansoni amine GPCR 0.007 0.0325 0.0636
Echinococcus multilocularis neuropeptides capa receptor 0.007 0.0325 0.0056
Echinococcus granulosus biogenic amine 5HT receptor 0.007 0.0325 0.0056
Schistosoma mansoni rhodopsin-like orphan GPCR 0.007 0.0325 0.0636
Loa Loa (eye worm) hypothetical protein 0.007 0.0325 0.0056
Loa Loa (eye worm) neuropeptide F receptor 0.007 0.0325 0.0056
Echinococcus multilocularis rhodopsin orphan GPCR 0.007 0.0325 0.0056
Echinococcus multilocularis neuropeptide receptor 0.007 0.0325 0.0056
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.007 0.0325 0.0056
Schistosoma mansoni opsin-like receptor 0.007 0.0325 0.0636

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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