Detailed information for compound 1125829

Basic information

Technical information
  • TDR Targets ID: 1125829
  • Name: 3-methyl-N-(6-methylpyridin-2-yl)-5-piperazin -1-yl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyraz olo[5,4-e]pyrimidin-7-amine
  • MW: 450.461 | Formula: C20H25F3N8O
  • H donors: 2 H acceptors: 4 LogP: 2.58 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cccc(n1)Nc1nc(nc2c1n(CCOCC(F)(F)F)nc2C)N1CCNCC1
  • InChi: 1S/C20H25F3N8O/c1-13-4-3-5-15(25-13)26-18-17-16(27-19(28-18)30-8-6-24-7-9-30)14(2)29-31(17)10-11-32-12-20(21,22)23/h3-5,24H,6-12H2,1-2H3,(H,25,26,27,28)
  • InChiKey: IVAPPJUVOQYBHT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-methyl-N-(6-methyl-2-pyridyl)-5-piperazin-1-yl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrazolo[5,4-e]pyrimidin-7-amine
  • 3-methyl-N-(6-methyl-2-pyridyl)-5-(1-piperazinyl)-1-[2-(2,2,2-trifluoroethoxy)ethyl]-7-pyrazolo[5,4-e]pyrimidinamine
  • [3-methyl-5-piperazin-1-yl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrazolo[5,4-e]pyrimidin-7-yl]-(6-methyl-2-pyridyl)amine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens potassium voltage-gated channel, subfamily H (eag-related), member 2 Starlite/ChEMBL References
Homo sapiens phosphodiesterase 5A, cGMP-specific Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) voltage and ligand gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania braziliensis cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Candida albicans similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania infantum cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania braziliensis cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma congolense cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum expressed protein Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Leishmania mexicana cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei gambiense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus multilocularis potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Trypanosoma brucei cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania mexicana cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma cruzi cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania infantum cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Candida albicans similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Trypanosoma congolense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus granulosus potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Potassium voltage-gated channel subfamily H member 2, putative Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Schistosoma japonicum Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Leishmania donovani cAMP specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei gambiense cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trypanosoma brucei cAMP-specific phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative Get druggable targets OG5_127318 All targets in OG5_127318
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase Get druggable targets OG5_127318 All targets in OG5_127318
Toxoplasma gondii hypothetical protein Get druggable targets OG5_127318 All targets in OG5_127318
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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1664 0.5748
Plasmodium vivax hypothetical protein, conserved 0.0023 0.064 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.1664 0.1664
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Mycobacterium leprae conserved hypothetical protein 0.0023 0.064 0.5
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1664 0.5748
Loa Loa (eye worm) TAR-binding protein 0.0074 0.2896 0.2896
Loa Loa (eye worm) hypothetical protein 0.0033 0.1042 0.1042
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0171 0.059
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0074 0.2896 0.2896
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.005 0.1826 0.6368
Plasmodium falciparum GAF domain-related protein, putative 0.0023 0.064 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0033 0.1042 0.3597
Schistosoma mansoni tar DNA-binding protein 0.0074 0.2896 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0013 0.0171 0.059
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0033 0.1042 0.1042
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0074 0.2868 1
Brugia malayi RNA binding protein 0.0074 0.2896 0.2896
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0012 0.013 0.0527
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.1664 0.1664
Echinococcus multilocularis voltage gated potassium channel 0.0013 0.0171 0.059
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.2466 0.8598
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0074 0.2868 0.9904
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis conserved hypothetical protein 0.0074 0.2868 1
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0074 0.2868 0.9904
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0023 0.064 0.5
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0009 0 0.5
Toxoplasma gondii hypothetical protein 0.0023 0.064 0.2594
Giardia lamblia hypothetical protein 0.0009 0 0.5
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0023 0.064 0.5
Mycobacterium ulcerans putative regulatory protein 0.0023 0.064 0.5
Brugia malayi TAR-binding protein 0.0074 0.2896 0.2896
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.2868 1
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1756 0.6065
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0074 0.2868 0.9904
Schistosoma mansoni tar DNA-binding protein 0.0074 0.2896 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.1445 0.5037
Brugia malayi RNA recognition motif domain containing protein 0.0074 0.2896 0.2896
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Toxoplasma gondii hypothetical protein 0.0065 0.2466 1
Mycobacterium ulcerans putative regulatory protein 0.0023 0.064 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1664 0.5748
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0074 0.2868 1
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0045 0.1575 0.1575
Giardia lamblia Hypothetical protein 0.0009 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0074 0.2896 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0074 0.2868 1
Schistosoma mansoni voltage-gated potassium channel 0.0013 0.0171 0.059
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.005 0.1826 0.6368
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0033 0.1042 0.1042
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1664 0.5748
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0033 0.1042 0.3632
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0045 0.1575 0.1575
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0033 0.1042 0.3597
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.1314 0.1314
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0033 0.1042 0.3632
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.064 0.2231
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.2466 0.8598
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0013 0.0171 0.059
Echinococcus granulosus tar DNA binding protein 0.0074 0.2896 1
Trichomonas vaginalis conserved hypothetical protein 0.0065 0.2466 0.8598
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1664 0.5748
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0234 1 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.005 0.1826 0.6368
Toxoplasma gondii GAF domain-containing protein 0.0023 0.064 0.2594
Loa Loa (eye worm) hypothetical protein 0.0023 0.064 0.064
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1664 0.5748
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0045 0.1575 0.5438
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0033 0.1042 0.3597
Loa Loa (eye worm) RNA binding protein 0.0074 0.2896 0.2896
Echinococcus granulosus voltage gated potassium channel 0.0013 0.0171 0.059
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.1445 0.5037
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0012 0.013 0.0527
Loa Loa (eye worm) hypothetical protein 0.0013 0.0171 0.0171
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0033 0.1042 0.3632
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1756 0.6065
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0023 0.064 0.5
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0045 0.1575 0.5438
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0013 0.0171 0.0171
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Toxoplasma gondii hypothetical protein 0.0023 0.064 0.2594
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0074 0.2868 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Echinococcus multilocularis tar DNA binding protein 0.0074 0.2896 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1664 0.5748
Schistosoma mansoni tar DNA-binding protein 0.0074 0.2896 1
Schistosoma mansoni tar DNA-binding protein 0.0074 0.2896 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0074 0.2868 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.78 nM Inhibition of PDE5 ChEMBL. 20400309
IC50 (binding) = 560 nM Inhibition of human ERG expressed by patch clam electrophysiology assay ChEMBL. 20400309
Inhibition (binding) = 40 % Displacement of [3H]dofetilide from human ERG expressed in HEK293 cells at 10 uM ChEMBL. 20400309

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

1 literature reference was collected for this gene.

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