Detailed information for compound 1389991

Basic information

Technical information
  • TDR Targets ID: 1389991
  • Name: ethyl 5-(cyclopentylcarbamoyl)-4-methyl-2-[(2 -thiophen-2-ylacetyl)amino]thiophene-3-carbox ylate
  • MW: 420.546 | Formula: C20H24N2O4S2
  • H donors: 2 H acceptors: 3 LogP: 4.44 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)c1c(NC(=O)Cc2cccs2)sc(c1C)C(=O)NC1CCCC1
  • InChi: 1S/C20H24N2O4S2/c1-3-26-20(25)16-12(2)17(18(24)21-13-7-4-5-8-13)28-19(16)22-15(23)11-14-9-6-10-27-14/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H,21,24)(H,22,23)
  • InChiKey: MKPNQSWRHDQJSM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • ethyl 5-(cyclopentylcarbamoyl)-4-methyl-2-[[2-(2-thienyl)acetyl]amino]thiophene-3-carboxylate
  • 5-[(cyclopentylamino)-oxomethyl]-4-methyl-2-[[1-oxo-2-(2-thienyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester
  • 5-(cyclopentylcarbamoyl)-4-methyl-2-[[2-(2-thienyl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester
  • ethyl 5-(cyclopentylcarbamoyl)-4-methyl-2-(2-thiophen-2-ylethanoylamino)thiophene-3-carboxylate
  • BAS 09587811
  • 5-Cyclopentylcarbamoyl-4-methyl-2-(2-thiophen-2-yl-acetylamino)-thiophene-3-carboxylic acid ethyl ester
  • A3095/0130988
  • MLS000528796
  • SMR000121271
  • Oprea1_107654
  • ZINC00815751

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens isocitrate dehydrogenase 1 (NADP+), soluble Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium knowlesi isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans C terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans N terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Theileria parva isocitrate dehydrogenase (NADP+), putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi Isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Neospora caninum Isocitrate dehydrogenase-like protein, related Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania mexicana isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium berghei isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Babesia bovis isocitrate dehydrogenase, NADP-dependent family protein Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Leishmania infantum isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Trypanosoma brucei gambiense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania donovani isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania braziliensis isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum hypothetical protein Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
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
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0092 0.0715 0.5
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0092 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.1237 1 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0.0121 0.5
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0092 0.0715 0.1726
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0092 0.0715 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0036 0.003
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0092 0.0715 0.1726
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.1144 0.9251 0.9247
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0092 0.0715 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.0121 0.0115
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Leishmania major hypothetical protein, conserved 0.0092 0.0715 1
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0092 0.0715 0.0709
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus granulosus dnaJ subfamily B 0.0494 0.3973 1
Leishmania major cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Onchocerca volvulus 0.0035 0.0247 0.5
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.1237 1 1
Schistosoma mansoni hypothetical protein 0.0494 0.3973 0.397
Loa Loa (eye worm) hypothetical protein 0.1144 0.9251 0.9247
Brugia malayi Isocitrate dehydrogenase 0.0019 0.0121 0.0069
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Leishmania major hypothetical protein, conserved 0.0092 0.0715 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.0121 0.0216
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.0121 0.0068
Loa Loa (eye worm) hypothetical protein 0.0092 0.0715 0.0666
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Brugia malayi isocitrate dehydrogenase 0.0019 0.0121 0.0069
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0092 0.0715 0.1726
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Plasmodium vivax cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0092 0.0715 0.1726
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0121 0.0216
Brugia malayi Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative 0.0092 0.0715 0.0667
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0092 0.0715 0.1726
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0092 0.0715 0.1726
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.1237 1 1
Schistosoma mansoni cpg binding protein 0.0035 0.0247 0.0241
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Schistosoma mansoni cpg binding protein 0.0037 0.0263 0.0257
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0053 0.0044
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0092 0.0715 0.1726
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Brugia malayi CXXC zinc finger family protein 0.0035 0.0247 0.0196
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Loa Loa (eye worm) hypothetical protein 0.1144 0.9251 0.9247
Giardia lamblia Hypothetical protein 0.0092 0.0715 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.0121 0.0216
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0092 0.0715 0.0667
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0092 0.0715 0.1726
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0092 0.0715 1
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0092 0.0715 1
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0092 0.0715 1
Trichomonas vaginalis helicase, putative 0.0008 0.003 0.0413
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0121 0.0216
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0092 0.0715 0.0667
Plasmodium falciparum phosphodiesterase delta, putative 0.0092 0.0715 1
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0092 0.0715 0.1726
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0092 0.0715 0.0709
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.0715 0.0666
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.003 0.0413
Trichomonas vaginalis conserved hypothetical protein 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0092 0.0715 0.1726
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0092 0.0715 0.1726
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Giardia lamblia hypothetical protein 0.0092 0.0715 0.5
Schistosoma mansoni cpg binding protein 0.0037 0.0263 0.0257
Plasmodium falciparum cGMP-specific phosphodiesterase 0.0092 0.0715 1
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.0715 0.0666
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.003 0.0413
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0092 0.0715 0.0667
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.3973 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0092 0.0715 1
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0092 0.0715 0.1726
Echinococcus granulosus cpg binding protein 0.0037 0.0263 0.0578
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.0121 0.0216
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Loa Loa (eye worm) PDE1B protein 0.0092 0.0715 0.0666
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0121 0.0216
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0563 0.0557
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0092 0.0715 0.1726
Echinococcus multilocularis cpg binding protein 0.0037 0.0263 0.0578
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Plasmodium falciparum phosphodiesterase gamma, putative 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0247 0.0195
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trypanosoma cruzi hypothetical protein, conserved 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0053 0.0044
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Trichomonas vaginalis conserved hypothetical protein 0.0092 0.0715 1
Plasmodium vivax phosphodiesterase gamma, putative 0.0092 0.0715 1
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0092 0.0715 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0092 0.0715 1
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0092 0.0715 0.1726
Plasmodium falciparum 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis conserved hypothetical protein 0.0092 0.0715 1
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0092 0.0715 1
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0092 0.0715 0.0667
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0092 0.0715 0.0709
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0092 0.0715 0.1726
Trypanosoma brucei hypothetical protein, conserved 0.0092 0.0715 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0499 0.6362
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.003 0.0413
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0092 0.0715 0.1726
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0092 0.0715 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.003 0.0413
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.0715 1
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0092 0.0715 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 79.37 um PUBCHEM_BIOASSAY: Dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 1 (SRC-1) recruitment by the peroxisome proliferator-activated receptor gamma (PPARgamma). (Class of assay: confirmatory) [Related pubchem assays: 631, 731, 1032, 1300 ] ChEMBL. No reference
EC50 (functional) > 79.37 um PUBCHEM_BIOASSAY: Dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 2 (SRC-2) recruitment by the peroxisome proliferator-activated receptor gamma (PPARgamma). (Class of assay: confirmatory) [Related pubchem assays: 1032, 631, 731 ] ChEMBL. No reference
EC50 (functional) > 79.37 um PUBCHEM_BIOASSAY: Dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 3 (SRC-3) recruitment by the peroxisome proliferator-activated receptor gamma (PPARgamma). (Class of assay: confirmatory) [Related pubchem assays: 1032, 631, 731 ] ChEMBL. No reference
Potency (functional) 0.0522 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.5131 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors: Potentiation with Lithium. (Class of assay: confirmatory) [Related pubchem assays: 901 ] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.