TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 380.483 | Formula: C22H28N4O2
H donors: 2 H acceptors: 4 LogP: 4.19 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(N(C1CCCCC1)C)CCCCc1ccc2c(c1)cc1c([nH]2)nc(n1)O
InChi: 1S/C22H28N4O2/c1-26(17-8-3-2-4-9-17)20(27)10-6-5-7-15-11-12-18-16(13-15)14-19-21(23-18)25-22(28)24-19/h11-14,17H,2-10H2,1H3,(H2,23,24,25,28)
InChiKey: OPXJIJPVHIVMBI-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	purinergic receptor P2Y, G-protein coupled, 12	Starlite/ChEMBL	References
Homo sapiens	phosphodiesterase 3A, cGMP-inhibited	Starlite/ChEMBL	References
Homo sapiens	phosphodiesterase 3B, cGMP-inhibited		References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132613	All targets in OG5_132613
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132613	All targets in OG5_132613
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	Get druggable targets OG5_132613	All targets in OG5_132613

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Mycobacterium ulcerans	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	0.1934	1	1
Leishmania major	trypanothione reductase	0.0096	0.0355	0.0549
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	conserved hypothetical protein	0.0099	0.0367	0.1156
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.022	0.1003	0.1377
Trypanosoma brucei	unspecified product	0.0059	0.0156	0.0205
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0033	0.0024	0.0037
Schistosoma mansoni	hypothetical protein	0.0109	0.0422	0.0618
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Brugia malayi	RNA binding protein	0.0064	0.0184	0.0249
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0616	0.3082	0.4745
Loa Loa (eye worm)	glutathione reductase	0.0096	0.0355	0.0506
Echinococcus granulosus	thymidylate synthase	0.1261	0.6464	1
Echinococcus multilocularis	dna polymerase eta	0.0085	0.0294	0.0419
Toxoplasma gondii	thioredoxin reductase	0.0096	0.0355	0.0514
Trypanosoma cruzi	trypanothione reductase, putative	0.0096	0.0355	0.0549
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0096	0.0355	0.0514
Chlamydia trachomatis	thymidylate kinase	0.0074	0.0235	0.0212
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0099	0.0367	0.0533
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0294	0.0411
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0059	0.0156	0.0197
Loa Loa (eye worm)	hypothetical protein	0.1099	0.5616	0.8682
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0099	0.0367	0.0533
Wolbachia endosymbiont of Brugia malayi	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	0.1934	1	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Mycobacterium tuberculosis	Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK)	0.0074	0.0235	0.0297
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.006	0.0057
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.022	0.1003	0.1377
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Loa Loa (eye worm)	calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase	0.0099	0.0367	0.0525
Plasmodium falciparum	thioredoxin reductase	0.0096	0.0355	0.0514
Trypanosoma brucei	DNA polymerase eta, putative	0.0085	0.0294	0.0419
Loa Loa (eye worm)	RNA binding protein	0.0064	0.0184	0.0241
Trypanosoma brucei	thymidylate kinase, putative	0.0074	0.0235	0.0328
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Echinococcus multilocularis	thymidylate synthase	0.1261	0.6464	1
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0099	0.0367	0.0533
Trichomonas vaginalis	calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma cruzi	cyclic nucleotide phosphodiesterase	0.0099	0.0367	0.0568
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Echinococcus multilocularis	geminin	0.0512	0.2533	0.3897
Loa Loa (eye worm)	hypothetical protein	0.005	0.0113	0.013
Trichomonas vaginalis	thymidylate kinase, putative	0.0074	0.0235	0.071
Schistosoma mansoni	cgmp-dependent 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Giardia lamblia	Myb 1-like protein	0.0038	0.0047	0.0076
Treponema pallidum	thymidylate kinase (tmk)	0.0074	0.0235	0.0212
Trypanosoma brucei	trypanothione reductase	0.0096	0.0355	0.0514
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Mycobacterium leprae	PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA	0.1389	0.7138	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Brugia malayi	hypothetical protein	0.0072	0.0224	0.0311
Echinococcus granulosus	thioredoxin glutathione reductase	0.0096	0.0355	0.0514
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0616	0.3082	0.4749
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Loa Loa (eye worm)	thymidylate kinase	0.0074	0.0235	0.032
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0059	0.0156	0.0205
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.006	0.0057
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma brucei	thymidylate kinase, putative	0.0074	0.0235	0.0328
Trypanosoma cruzi	thymidylate kinase, putative	0.0074	0.0235	0.0363
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Echinococcus granulosus	dna polymerase eta	0.0085	0.0294	0.0419
Schistosoma mansoni	DNA polymerase eta	0.0085	0.0294	0.0419
Echinococcus granulosus	cAMP and cAMP inhibited cGMP 3'5' cyclic	0.0099	0.0367	0.0533
Entamoeba histolytica	hypothetical protein	0.0072	0.0224	0.9431
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0099	0.0367	0.0568
Schistosoma mansoni	hypothetical protein	0.0512	0.2533	0.3897
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trichomonas vaginalis	MYB, putative	0.0038	0.0047	0.0079
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0099	0.0367	0.0533
Echinococcus multilocularis	tar DNA binding protein	0.0064	0.0184	0.0249
Leishmania major	hypothetical protein, conserved	0.0099	0.0367	0.0568
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Plasmodium vivax	phosphodiesterase gamma, putative	0.0099	0.0367	0.0533
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Loa Loa (eye worm)	thymidylate synthase	0.1261	0.6464	1
Brugia malayi	TAR-binding protein	0.0064	0.0184	0.0249
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0064	0.0184	0.0241
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0616	0.3082	0.4749
Mycobacterium tuberculosis	Probable oxidoreductase	0.0245	0.1132	0.1558
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	0.0517	0.2563	0.3938
Giardia lamblia	Hypothetical protein	0.0099	0.0367	0.1123
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0616	0.3082	0.4749
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0059	0.0156	0.0241
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0367	0.0525
Leishmania major	DNA polymerase eta, putative	0.0044	0.0081	0.0126
Chlamydia trachomatis	phosphoshikimate 1-carboxyl vinyltransferase	0.0545	0.271	0.2693
Brugia malayi	thymidylate kinase	0.0074	0.0235	0.0328
Plasmodium falciparum	phosphodiesterase delta, putative	0.0099	0.0367	0.0533
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Echinococcus granulosus	high affinity cgmp specific 3' 5' cyclic	0.0099	0.0367	0.0533
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0099	0.0367	0.0533
Mycobacterium tuberculosis	Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA	0.1389	0.7138	1
Plasmodium vivax	glutathione reductase, putative	0.0096	0.0355	0.0514
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Echinococcus multilocularis	dna polymerase kappa	0.0059	0.0156	0.0205
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0099	0.0367	0.0533
Brugia malayi	MH2 domain containing protein	0.036	0.174	0.2665
Trypanosoma brucei	unspecified product	0.004	0.006	0.0057
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0029	0.0008
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative	0.0099	0.0367	0.0533
Toxoplasma gondii	shikimate dehydrogenase substrate binding domain-containing protein	0.0545	0.271	0.4171
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0099	0.0367	0.0533
Mycobacterium ulcerans	thymidylate synthase	0.1261	0.6464	0.6456
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0245	0.1132	0.1558
Trichomonas vaginalis	pc-MYB2, putative	0.0038	0.0046	0.0076
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.0616	0.3082	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	MYB72, putative	0.0038	0.0046	0.0076
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0517	0.2563	0.3943
Loa Loa (eye worm)	MH2 domain-containing protein	0.036	0.174	0.2659
Entamoeba histolytica	hypothetical protein	0.0072	0.0224	0.9431
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0033	0.0024	0.0037
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0184	0.0249
Brugia malayi	glutathione reductase	0.0096	0.0355	0.0514
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Mycobacterium ulcerans	DNA polymerase IV	0.0059	0.0156	0.0132
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.022	0.1003	0.1377
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0033	0.0024	0.0037
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0044	0.0081	0.0089
Schistosoma mansoni	hypothetical protein	0.0074	0.0235	0.0328
Schistosoma mansoni	hypothetical protein	0.0034	0.0029	0.0008
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0059	0.0156	0.0445
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0059	0.0156	0.0241
Treponema pallidum	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	0.1934	1	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.0113	0.013
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0184	0.0249
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Wolbachia endosymbiont of Brugia malayi	thymidylate kinase	0.0074	0.0235	0.0212
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.1261	0.6464	0.9053
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0367	0.0525
Trichomonas vaginalis	C-MYB, putative	0.0038	0.0046	0.0076
Plasmodium falciparum	glutathione reductase	0.0096	0.0355	0.0514
Brugia malayi	Thioredoxin reductase	0.0096	0.0355	0.0514
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0072	0.0224	0.0311
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0099	0.0367	0.0568
Leishmania major	DNA polymerase kappa, putative	0.0059	0.0156	0.0241
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Echinococcus multilocularis	thymidylate kinase	0.0074	0.0235	0.0328
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Mycobacterium leprae	probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS	0.0545	0.271	0.3586
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0059	0.0156	0.0205
Trypanosoma brucei	DNA polymerase IV, putative	0.0059	0.0156	0.0205
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0033	0.0024	0.0037
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0616	0.3082	0.4749
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0059	0.0156	0.0241
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0517	0.2563	0.3943
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Loa Loa (eye worm)	thioredoxin reductase	0.0096	0.0355	0.0506
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.006	0.0057
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Trichomonas vaginalis	thymidylate kinase, putative	0.0074	0.0235	0.071
Brugia malayi	ImpB/MucB/SamB family protein	0.0085	0.0294	0.0419
Mycobacterium tuberculosis	Probable reductase	0.022	0.1003	0.1377
Trypanosoma cruzi	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0099	0.0367	0.0568
Mycobacterium ulcerans	thymidylate kinase	0.0074	0.0235	0.0212
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.1099	0.5616	0.8683
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0046	0.0076
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0099	0.0367	0.0533
Leishmania major	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0059	0.0156	0.0205
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.022	0.1003	0.1113
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Entamoeba histolytica	hypothetical protein	0.0072	0.0224	0.9431
Plasmodium vivax	cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.0533
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0099	0.0367	0.0533
Plasmodium vivax	thioredoxin reductase, putative	0.0096	0.0355	0.0514
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0059	0.0156	0.0241
Trypanosoma cruzi	trypanothione reductase, putative	0.0033	0.0024	0.0037
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0099	0.0367	0.0533
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0059	0.0156	0.0205
Entamoeba histolytica	hypothetical protein	0.0072	0.0224	0.9431
Toxoplasma gondii	Myb family DNA-binding domain-containing protein	0.0038	0.0047	0.0036
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0059	0.0156	0.0186
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0099	0.0367	0.0533
Schistosoma mansoni	hypothetical protein	0.0512	0.2533	0.3897
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0099	0.0367	0.0533
Loa Loa (eye worm)	PDE1B protein	0.0099	0.0367	0.0525
Brugia malayi	hypothetical protein	0.06	0.2996	0.4614
Entamoeba histolytica	Thymidylate kinase, putative	0.0074	0.0235	1
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Onchocerca volvulus		0.1261	0.6464	1
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0245	0.1132	0.13
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Loa Loa (eye worm)	TAR-binding protein	0.0064	0.0184	0.0241
Leishmania major	thymidylate kinase-like protein	0.0074	0.0235	0.0363
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0059	0.0156	0.0241
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Echinococcus granulosus	thymidylate kinase	0.0074	0.0235	0.0328
Schistosoma mansoni	thymidylate kinase	0.0074	0.0235	0.0328
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0047	0.0079
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0099	0.0367	0.0533
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0059	0.0156	0.0205
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Echinococcus granulosus	high affinity cAMP specific 3'5' cyclic	0.0099	0.0367	0.0533
Mycobacterium tuberculosis	Hypothetical protein	0.06	0.2996	0.4177
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.022	0.1003	0.1377
Brugia malayi	ImpB/MucB/SamB family protein	0.0059	0.0156	0.0205
Trypanosoma cruzi	hypothetical protein, conserved	0.0099	0.0367	0.0568
Schistosoma mansoni	hypothetical protein	0.0072	0.0224	0.0311
Schistosoma mansoni	transcription factor LCR-F1	0.0072	0.0224	0.0311
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0059	0.0156	0.0186
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0059	0.0156	0.5819
Leishmania major	DNA polymerase eta, putative	0.0085	0.0294	0.0454
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Echinococcus granulosus	tar DNA binding protein	0.0064	0.0184	0.0249
Brugia malayi	RNA recognition motif domain containing protein	0.0064	0.0184	0.0249
Mycobacterium leprae	PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE)	0.1261	0.6464	0.9024
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0096	0.0355	0.0465
Trichomonas vaginalis	conserved hypothetical protein	0.0099	0.0367	0.1156
Trypanosoma brucei	unspecified product	0.004	0.006	0.0057
Mycobacterium ulcerans	3-phosphoshikimate 1-carboxyvinyltransferase	0.0545	0.271	0.2693
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0517	0.2563	0.3943
Giardia lamblia	DINP protein human, muc B family	0.0059	0.0156	0.0432
Trichomonas vaginalis	conserved hypothetical protein	0.0099	0.0367	0.1156
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Trichomonas vaginalis	conserved hypothetical protein	0.06	0.2996	1
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Echinococcus granulosus	dna polymerase kappa	0.0059	0.0156	0.0205
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0245	0.1132	0.1558
Plasmodium falciparum	phosphodiesterase gamma, putative	0.0099	0.0367	0.0533
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0072	0.0224	0.0311
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.0113	0.0138
Trichomonas vaginalis	DNA polymerase eta, putative	0.0059	0.0156	0.0445
Trypanosoma brucei	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.0533
Trichomonas vaginalis	C-MYB, putative	0.0038	0.0046	0.0076
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0099	0.0367	0.0533
Plasmodium vivax	thymidylate kinase, putative	0.0074	0.0235	0.0328
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0099	0.0367	0.0533
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Schistosoma mansoni	thymidylate kinase	0.0074	0.0235	0.0328
Brugia malayi	thymidylate synthase	0.1261	0.6464	1
Schistosoma mansoni	camp-specific cyclic nucleotide phosphodiesterase	0.0099	0.0367	0.0533
Trypanosoma cruzi	DNA polymerase eta, putative	0.0085	0.0294	0.0454
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0616	0.3082	0.4749
Trichomonas vaginalis	r2r3-MYB transcription factor, putative	0.0038	0.0047	0.0079
Loa Loa (eye worm)	hypothetical protein	0.1	0.5097	0.7875
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0033	0.0024	0.0037
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0099	0.0367	0.0533
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase, putative	0.06	0.2996	0.4634
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Giardia lamblia	hypothetical protein	0.0099	0.0367	0.1123
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trichomonas vaginalis	pc-MYB2, putative	0.0038	0.0046	0.0076
Trypanosoma brucei	hypothetical protein, conserved	0.0099	0.0367	0.0533
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trichomonas vaginalis	MYB3r3, putative	0.0038	0.0046	0.0076
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.1261	0.6464	1
Echinococcus multilocularis	high affinity cgmp specific 3' 5' cyclic	0.0099	0.0367	0.0533
Echinococcus granulosus	geminin	0.0512	0.2533	0.3897
Mycobacterium ulcerans	DNA polymerase IV	0.0059	0.0156	0.0132
Plasmodium falciparum	thymidylate kinase	0.0074	0.0235	0.0328
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.0113	0.0138
Mycobacterium tuberculosis	Probable dehydrogenase	0.022	0.1003	0.1377
Trypanosoma cruzi	thymidylate kinase, putative	0.0074	0.0235	0.0363
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.1156
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0099	0.0367	0.0568
Trypanosoma brucei	RNA helicase, putative	0.0109	0.0422	0.0618
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0099	0.0367	0.0533
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0184	0.0249
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0616	0.3082	0.4749
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0184	0.0249
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0099	0.0367	0.0533
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0099	0.0367	0.0533
Echinococcus multilocularis	cAMP and cAMP inhibited cGMP 3',5' cyclic	0.0099	0.0367	0.0533
Echinococcus multilocularis	high affinity cAMP specific 3',5' cyclic	0.0099	0.0367	0.0533
Trypanosoma brucei	DNA polymerase IV, putative	0.0059	0.0156	0.0205
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0099	0.0367	0.1156
Giardia lamblia	CDC8	0.0074	0.0235	0.069
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.1261	0.6464	1
Toxoplasma gondii	thymidylate kinase	0.0074	0.0235	0.0328
Trypanosoma brucei	DNA polymerase kappa, putative	0.0059	0.0156	0.0205
Trypanosoma cruzi	DNA polymerase eta, putative	0.0044	0.0081	0.0126
Leishmania major	hypothetical protein, conserved	0.0099	0.0367	0.0568
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0099	0.0367	0.1156
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0184	0.0249
Loa Loa (eye worm)	transcription factor SMAD2	0.036	0.174	0.2659

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 0.026 uM	Inhibition of platelet aggregation using collagen as activating agent in rabbit platelet rich plasma (PRP)	ChEMBL.	1321910
EC50 (functional)	= 0.21 uM	Inhibition of platelet aggregation using Adenosine diphosphate (ADP) as activating agent in rabbit platelet rich plasma (PRP)	ChEMBL.	1321910
EC50 (functional)	= 0.21 uM	Inhibition of platelet aggregation using Adenosine diphosphate (ADP) as activating agent in rabbit platelet rich plasma (PRP)	ChEMBL.	1321910
EC50 (functional)	= 1.1 uM	Inhibition of platelet aggregation using adenosine diphosphate (ADP) as activating agent in human platelet rich plasma (PRP)	ChEMBL.	1321910
EC50 (functional)	= 1.1 uM	Inhibition of platelet aggregation using adenosine diphosphate (ADP) as activating agent in human platelet rich plasma (PRP)	ChEMBL.	1321910
IC50 (binding)	uM	Inhibition of human platelet PDE by inhibiting cyclic Guanosine monophosphate (cGMP) hydrolysis; Not tested	ChEMBL.	1321910
IC50 (binding)	0 uM	Inhibition of human platelet PDE by inhibiting cyclic Guanosine monophosphate (cGMP) hydrolysis; Not tested	ChEMBL.	1321910
IC50 (binding)	= 0.04 uM	Inhibition of human platelet PDE by inhibiting cyclic Adenosine monophosphate (cAMP) hydrolysis	ChEMBL.	1321910
IC50 (binding)	= 0.04 uM	Inhibition of human platelet PDE by inhibiting cyclic Adenosine monophosphate (cAMP) hydrolysis	ChEMBL.	1321910

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

ChEMBL: CHEMBL88708

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 147844