Detailed information for compound 1536056

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 294.323 | Formula: C18H15FN2O
  • H donors: 0 H acceptors: 2 LogP: 5 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1ccc(cc1)c1onc(n1)/C=C/c1ccc(cc1)F
  • InChi: 1S/C18H15FN2O/c1-2-13-3-8-15(9-4-13)18-20-17(21-22-18)12-7-14-5-10-16(19)11-6-14/h3-12H,2H2,1H3/b12-7+
  • InChiKey: GOYZURAYKXYTMS-KPKJPENVSA-N  


Substructure search Similarity search

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
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.13 0.3886 0.8614
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.018 0.0308 0.1213
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.018 0.0308 0.1213
Trypanosoma brucei telomerase reverse transcriptase 0.0878 0.2537 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis conserved hypothetical protein 0.018 0.0308 0.5
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.5
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.13 0.3886 0.5195
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Mycobacterium tuberculosis Probable DNA polymerase I PolA 0.0118 0.0109 1
Plasmodium falciparum phosphodiesterase gamma, putative 0.018 0.0308 0.1213
Trypanosoma brucei cAMP-specific phosphodiesterase 0.018 0.0308 0.1213
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium vivax phosphodiesterase gamma, putative 0.018 0.0308 0.1213
Plasmodium falciparum phosphodiesterase delta, putative 0.018 0.0308 0.1213
Leishmania major cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.1213
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.1213
Leishmania major hypothetical protein, conserved 0.018 0.0308 0.1213
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.018 0.0308 0.1213
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium falciparum telomerase reverse transcriptase 0.0878 0.2537 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.13 0.3886 0.8614
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0878 0.2537 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.018 0.0308 0.1213
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.018 0.0308 0.1213
Chlamydia trachomatis DNA polymerase I 0.0118 0.0109 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0878 0.2537 1
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.148 0.4462 1
Mycobacterium leprae PROBABLE DNA POLYMERASE I POLA 0.0118 0.0109 0.5
Plasmodium falciparum cGMP-specific phosphodiesterase 0.018 0.0308 0.1213
Brugia malayi Telomerase reverse transcriptase 0.2336 0.7195 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.148 0.4462 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.148 0.4462 1
Toxoplasma gondii RNA-directed DNA polymerase 0.0878 0.2537 0.5366
Trichomonas vaginalis conserved hypothetical protein 0.018 0.0308 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Leishmania major hypothetical protein, conserved 0.018 0.0308 0.1213
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213
Giardia lamblia Telomerase catalytic subunit 0.0878 0.2537 0.5366
Mycobacterium ulcerans DNA polymerase I 0.0118 0.0109 1
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.13 0.3886 0.8614
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.148 0.4462 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.018 0.0308 0.1213
Loa Loa (eye worm) hypothetical protein 0.148 0.4462 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.148 0.4462 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.148 0.4462 1
Trypanosoma brucei hypothetical protein, conserved 0.018 0.0308 0.1213
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.1213
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Plasmodium vivax telomerase reverse transcriptase, putative 0.0878 0.2537 1
Treponema pallidum DNA polymerase I (polA) 0.0118 0.0109 0.5
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.018 0.0308 0.1213
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Leishmania major telomerase reverse transcriptase, putative 0.0878 0.2537 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis conserved hypothetical protein 0.018 0.0308 0.5
Wolbachia endosymbiont of Brugia malayi DNA polymerase I 0.0118 0.0109 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase 0.018 0.0308 0.1213
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.148 0.4462 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.018 0.0308 0.5
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.5
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.018 0.0308 0.1213
Plasmodium falciparum cGMP-specific phosphodiesterase 0.018 0.0308 0.1213
Trypanosoma cruzi hypothetical protein, conserved 0.018 0.0308 0.1213

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific proteases (SENPs) using a Caspase-3 Selectivity assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2599, AID434973, AID489001] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 6 (SENP6) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2582, AID2599] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 7 (SENP7) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID434973, AID434986] ChEMBL. No reference
IC50 (functional) > 99 uM PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of Sentrin-specific protease 8 (SENP8) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2575] 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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