Detailed information for compound 1761431

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 451.559 | Formula: C29H29N3O2
  • H donors: 0 H acceptors: 1 LogP: 6.31 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCn1c(=O)nc(c2c1c1cc(ccc1o2)c1ccc(cc1)CN(C)C)c1ccccc1
  • InChi: 1S/C29H29N3O2/c1-4-5-17-32-27-24-18-23(21-13-11-20(12-14-21)19-31(2)3)15-16-25(24)34-28(27)26(30-29(32)33)22-9-7-6-8-10-22/h6-16,18H,4-5,17,19H2,1-3H3
  • InChiKey: KMFHDWVKYPJZDS-UHFFFAOYSA-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
Brugia malayi Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog 0.0435 0.0302 1
Loa Loa (eye worm) calcium channel 0.0435 0.0302 1
Brugia malayi olfactory channel protein osm-9 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Schistosoma mansoni transient receptor potential channel 0.0435 0.0302 0.00000051681
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0435 0.0302 0.5
Echinococcus multilocularis transient receptor potential cation channel 0.2813 0.9972 0.9971
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Brugia malayi voltage-dependent calcium channel 0.0435 0.0302 1
Brugia malayi ion channel NompC 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Schistosoma mansoni transient receptor potential channel 0.0435 0.0302 0.00000051681
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Toxoplasma gondii transporter, cation channel family protein 0.0435 0.0302 0.5
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Leishmania major hypothetical protein, unknown function 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Leishmania major hypothetical protein, conserved 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0435 0.0302 1
Toxoplasma gondii transporter, cation channel family protein 0.0435 0.0302 0.5
Loa Loa (eye worm) voltage-gated potassium channel 0.0435 0.0302 1
Brugia malayi cation channel family protein 0.0435 0.0302 1
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0435 0.0302 0.5
Brugia malayi Ryanodine Receptor TM 4-6 family protein 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0435 0.0302 1
Toxoplasma gondii hypothetical protein 0.0435 0.0302 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0435 0.0302 0.5
Brugia malayi Cyclic-nucleotide gated cation channel 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit 0.0435 0.0302 1
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.0435 0.0302 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.282 1 1
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.0435 0.0302 1
Echinococcus granulosus ankyrin repeat protein 0.2378 0.8205 0.8149
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0435 0.0302 1
Brugia malayi cation channel family protein 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0435 0.0302 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0435 0.0302 0.5
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Brugia malayi hypothetical protein 0.0435 0.0302 1
Brugia malayi Voltage-gated calcium channel, alpha subunit 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) ion channel NompC 0.0435 0.0302 1
Loa Loa (eye worm) voltage-gated calcium channel 0.0435 0.0302 1
Toxoplasma gondii hypothetical protein 0.0435 0.0302 0.5
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0435 0.0302 1
Loa Loa (eye worm) voltage-gated potassium channel 0.0435 0.0302 1
Echinococcus granulosus transient receptor potential cation channel 0.0435 0.0302 0.00000042114
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Echinococcus granulosus transient receptor potential cation channel 0.2813 0.9972 0.9971
Loa Loa (eye worm) voltage-dependent calcium channel 0.0435 0.0302 1
Echinococcus multilocularis ankyrin repeat protein 0.2378 0.8205 0.8149
Loa Loa (eye worm) ryanodine receptor 0.0435 0.0302 1
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0435 0.0302 1
Onchocerca volvulus 0.0435 0.0302 0.5
Toxoplasma gondii transporter, cation channel family protein 0.0435 0.0302 0.5
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Schistosoma mansoni transient receptor potential cation channel subfamily A member 0.2378 0.8205 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0435 0.0302 0.5
Brugia malayi Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Echinococcus granulosus transient receptor potential cation channel 0.0435 0.0302 0.00000042114
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.0435 0.0302 1
Echinococcus multilocularis transient receptor potential cation channel 0.0435 0.0302 0.00000042114
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0435 0.0302 1
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0435 0.0302 1
Echinococcus multilocularis transient receptor potential cation channel 0.0435 0.0302 0.00000042114
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog 0.0435 0.0302 1
Brugia malayi Transient-receptor-potential like protein 0.0435 0.0302 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0435 0.0302 0.5
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 1
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0435 0.0302 1
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0435 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0435 0.0302 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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