TDR Targets

Basic information

Technical information

TDR Targets ID: 1368583
Name: N-(2,4-dimethoxyphenyl)-2-[4-thiophen-2-yl-6- (trifluoromethyl)pyrimidin-2-yl]sulfanylaceta mide
MW: 455.474 | Formula: C19H16F3N3O3S2
H donors: 1 H acceptors: 3 LogP: 4.19 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(c(c1)OC)NC(=O)CSc1nc(cc(n1)C(F)(F)F)c1cccs1
InChi: 1S/C19H16F3N3O3S2/c1-27-11-5-6-12(14(8-11)28-2)23-17(26)10-30-18-24-13(15-4-3-7-29-15)9-16(25-18)19(20,21)22/h3-9H,10H2,1-2H3,(H,23,26)
InChiKey: YVTLGFRJARSZMD-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

N-(2,4-dimethoxyphenyl)-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide
N-(2,4-dimethoxyphenyl)-2-[[4-(2-thienyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide
N-(2,4-dimethoxyphenyl)-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide
N-(2,4-dimethoxyphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide
NCGC00101298-01
BAS 03153567
ST5270163

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Homo sapiens	TAR DNA binding protein	Starlite/ChEMBL	No references
Homo sapiens	thyroid hormone receptor, beta	Starlite/ChEMBL	No references
Homo sapiens	ataxin 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	RNA recognition motif domain containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma mansoni	thyroid hormone receptor	Get druggable targets OG5_134830	All targets in OG5_134830
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	Thyroid hormone receptor alpha, putative	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	Get druggable targets OG5_134830	All targets in OG5_134830
Brugia malayi	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	ko:K08362 nuclear receptor, subfamily 1, group A, member 2, putative	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	Thyroid hormone receptor alpha, putative	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma japonicum	expressed protein	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_134830	All targets in OG5_134830
Brugia malayi	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus multilocularis	thyroid hormone receptor alpha	Get druggable targets OG5_134830	All targets in OG5_134830
Schistosoma mansoni	thyroid hormone receptor	Get druggable targets OG5_134830	All targets in OG5_134830
Echinococcus multilocularis	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	photoreceptor-specific nuclear receptor	thyroid hormone receptor, beta	461 aa	414 aa	24.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0051	0.0398	0.0356
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Leishmania major	prostaglandin f2-alpha synthase/D-arabinose dehydrogenase	0.0032	0.0156	0.0177
Echinococcus granulosus	aldo keto reductase	0.0032	0.0156	0.0113
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0277	0.3164	1
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0104	0.1041	0.329
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0277	0.3164	1
Loa Loa (eye worm)	oxidoreductase	0.0032	0.0156	0.0363
Echinococcus granulosus	high affinity cgmp specific 3' 5' cyclic	0.0051	0.0398	0.0356
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0032	0.0156	0.0405
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0277	0.3164	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0051	0.0398	0.1064
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.03	0.0258
Plasmodium falciparum	phosphodiesterase delta, putative	0.0051	0.0398	0.2692
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Entamoeba histolytica	hypothetical protein	0.0043	0.03	0.0478
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trypanosoma cruzi	cyclic nucleotide phosphodiesterase	0.0051	0.0398	0.2857
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0051	0.0398	0.2857
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0164	0.1784	0.1748
Echinococcus granulosus	Polycystic kidney disease protein	0.0139	0.1477	0.144
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Brugia malayi	Doublecortin family protein	0.0139	0.1477	0.4011
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2692
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0139	0.1477	0.144
Echinococcus granulosus	cAMP and cAMP inhibited cGMP 3'5' cyclic	0.007	0.0631	0.0591
Onchocerca volvulus		0.0139	0.1477	0.4391
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0051	0.0398	0.1064
Schistosoma mansoni	hypothetical protein	0.0152	0.1634	0.1501
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0369	0.4303	0.4212
Loa Loa (eye worm)	hypothetical protein	0.0369	0.4303	1
Mycobacterium leprae	PROBABLE OXIDOREDUCTASE	0.0032	0.0156	1
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0369	0.4303	0.4278
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Trichomonas vaginalis	conserved hypothetical protein	0.0051	0.0398	0.1257
Schistosoma mansoni	polycystin 1-related	0.0139	0.1477	0.1342
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0277	0.3164	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Brugia malayi	RNA binding protein	0.0076	0.0706	0.1906
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0706	0.0559
Plasmodium vivax	phosphodiesterase gamma, putative	0.0051	0.0398	0.2692
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0277	0.3164	0.8616
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2692
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0104	0.1041	0.1002
Trypanosoma brucei	aldo-keto reductase, putative	0.0032	0.0156	0.0177
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0277	0.3164	1
Echinococcus granulosus	tar DNA binding protein	0.0076	0.0706	0.0666
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0318	0.3671	0.3644
Trypanosoma cruzi	cAMP-specific phosphodiesterase, putative	0.0051	0.0398	0.2857
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2692
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0051	0.0398	0.0245
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0032	0.0156	0.0493
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.007	0.0631	0.1995
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Trichomonas vaginalis	conserved hypothetical protein	0.0104	0.1041	0.329
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0369	0.4303	1
Schistosoma mansoni	thyroid hormone receptor	0.0164	0.1784	0.1654
Trypanosoma brucei	cAMP-specific phosphodiesterase, putative	0.0051	0.0398	0.2857
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2857
Mycobacterium ulcerans	oxidoreductase	0.0032	0.0156	0.0493
Brugia malayi	hypothetical protein	0.003	0.014	0.0362
Echinococcus multilocularis	high affinity cgmp specific 3' 5' cyclic	0.0051	0.0398	0.0356
Leishmania major	hypothetical protein, conserved	0.0051	0.0398	0.2857
Leishmania major	hypothetical protein, conserved	0.0051	0.0398	0.2857
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0277	0.3164	1
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0085	0.0807	0.7406
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.1257
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0139	0.1477	0.144
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0706	0.0559
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trypanosoma brucei	hypothetical protein, conserved	0.0051	0.0398	0.2857
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trypanosoma cruzi	aldo/keto reductase, putative	0.0032	0.0156	0.0177
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0104	0.1041	1
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0051	0.0398	0.1064
Echinococcus multilocularis	RUN	0.0139	0.1477	0.144
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative	0.007	0.0631	0.1702
Trichomonas vaginalis	aldo/keto reductase, putative	0.0032	0.0156	0.0493
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.007	0.0631	0.1995
Mycobacterium tuberculosis	Probable oxidoreductase	0.0032	0.0156	0.0493
Mycobacterium leprae	Conserved hypothetical protein	0.0023	0.0043	0.2767
Toxoplasma gondii	LsmAD domain-containing protein	0.003	0.014	0.0326
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0104	0.1041	1
Echinococcus granulosus	RUN	0.0139	0.1477	0.144
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	conserved hypothetical protein	0.0051	0.0398	0.1257
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0277	0.3164	0.7254
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.007	0.0631	0.1995
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Echinococcus multilocularis	Polycystic kidney disease protein	0.0139	0.1477	0.144
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Loa Loa (eye worm)	RNA binding protein	0.0076	0.0706	0.1641
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Onchocerca volvulus		0.0139	0.1477	0.4391
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0318	0.3671	1
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0152	0.1634	0.1598
Echinococcus granulosus	aldo keto reductase	0.0032	0.0156	0.0113
Toxoplasma gondii	hypothetical protein	0.0052	0.041	0.0952
Loa Loa (eye worm)	oxidoreductase	0.0032	0.0156	0.0363
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0398	0.0924
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.0706	0.0666
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0051	0.0398	0.2692
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0032	0.0156	0.0493
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0051	0.0398	0.2857
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Trichomonas vaginalis	aldo/keto reductase, putative	0.0032	0.0156	0.0493
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.007	0.0631	0.1702
Echinococcus multilocularis	aldo keto reductase	0.0032	0.0156	0.0113
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Schistosoma mansoni	camp-specific cyclic nucleotide phosphodiesterase	0.0051	0.0398	0.0245
Loa Loa (eye worm)	calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase	0.0051	0.0398	0.0924
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0051	0.0398	0.2857
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0051	0.0398	0.0356
Leishmania major	aldo-keto reductase-like protein	0.0032	0.0156	0.0177
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.03	0.0258
Trypanosoma cruzi	aldo-keto reductase	0.0032	0.0156	0.0177
Echinococcus multilocularis	aldo keto reductase	0.0032	0.0156	0.0113
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0051	0.0398	0.0356
Entamoeba histolytica	hypothetical protein	0.0043	0.03	0.0478
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0277	0.3164	1
Echinococcus multilocularis	high affinity cAMP specific 3',5' cyclic	0.0051	0.0398	0.0356
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Plasmodium falciparum	phosphodiesterase gamma, putative	0.0051	0.0398	0.2692
Loa Loa (eye worm)	doublecortin family protein	0.0139	0.1477	0.3433
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0104	0.1041	0.0899
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Loa Loa (eye worm)	hypothetical protein	0.007	0.0631	0.1467
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0051	0.0398	0.2857
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2692
Onchocerca volvulus		0.0277	0.3164	1
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0706	0.0559
Brugia malayi	hypothetical protein	0.0139	0.1477	0.4011
Echinococcus granulosus	high affinity cAMP specific 3'5' cyclic	0.0051	0.0398	0.0356
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.041	0.1295
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.014	0.0949
Leishmania major	aldehyde reductase, putative,oxidoreductase, putative	0.0032	0.0156	0.0177
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.014	0.0949
Plasmodium vivax	multidomain scavenger receptor, putative	0.0139	0.1477	1
Brugia malayi	hypothetical protein	0.0043	0.03	0.0798
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Leishmania major	cAMP-specific phosphodiesterase, putative	0.0051	0.0398	0.2857
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0085	0.0807	0.2552
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0277	0.3164	1
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.0369	0.4303	1
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Giardia lamblia	Hypothetical protein	0.0051	0.0398	0.0582
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Echinococcus granulosus	aldo keto reductase	0.0032	0.0156	0.0113
Leishmania major	prostaglandin f synthase, putative	0.0032	0.0156	0.0177
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Loa Loa (eye worm)	oxidoreductase	0.0032	0.0156	0.0363
Echinococcus multilocularis	cAMP and cAMP inhibited cGMP 3',5' cyclic	0.007	0.0631	0.0591
Trypanosoma brucei	prostaglandin f synthase	0.0032	0.0156	0.0177
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.0277	0.3164	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.0032	0.0156	0.0493
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0051	0.0398	0.2692
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.0706	0.1641
Schistosoma mansoni	loxhd1	0.0139	0.1477	0.1342
Schistosoma mansoni	hypothetical protein	0.0043	0.03	0.0146
Entamoeba histolytica	hypothetical protein	0.0043	0.03	0.0478
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Schistosoma mansoni	lipoxygenase	0.0833	1	1
Schistosoma mansoni	hypothetical protein	0.0139	0.1477	0.1342
Loa Loa (eye worm)	PDE1B protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.041	0.1295
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0104	0.1041	0.1002
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.1257
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0277	0.3164	1
Echinococcus multilocularis	aldo keto reductase	0.0032	0.0156	0.0113
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Loa Loa (eye worm)	hypothetical protein	0.0139	0.1477	0.3433
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0369	0.4303	0.4278
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Plasmodium vivax	cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2692
Loa Loa (eye worm)	oxidoreductase	0.0032	0.0156	0.0363
Brugia malayi	TAR-binding protein	0.0076	0.0706	0.1906
Giardia lamblia	hypothetical protein	0.0051	0.0398	0.0582
Entamoeba histolytica	hypothetical protein	0.0043	0.03	0.0478
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Echinococcus granulosus	hypothetical protein	0.0032	0.0156	0.0113
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0104	0.1041	1
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0152	0.1634	0.1598
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Schistosoma mansoni	lipoxygenase	0.0582	0.6921	0.6872
Loa Loa (eye worm)	oxidoreductase	0.0032	0.0156	0.0363
Toxoplasma gondii	aldose reductase, putative	0.0032	0.0156	0.0363
Schistosoma mansoni	rab6-interacting	0.0139	0.1477	0.1342
Loa Loa (eye worm)	hypothetical protein	0.0139	0.1477	0.3433
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0032	0.0156	0.0405
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0032	0.0156	0.0405
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0085	0.0807	0.2552
Echinococcus granulosus	lipoxygenase domain containing protein	0.0139	0.1477	0.144
Schistosoma mansoni	thyroid hormone receptor	0.0164	0.1784	0.1654
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0369	0.4303	0.4278
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.03	0.0146
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.1257
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0706	0.0559
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0104	0.1041	0.329
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0051	0.0398	0.1064
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	0.0318	0.3671	0.8533
Echinococcus multilocularis	aldo keto reductase	0.0032	0.0156	0.0113
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0156	0.0363
Trypanosoma cruzi	hypothetical protein, conserved	0.0051	0.0398	0.2857
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0051	0.0398	0.0245
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0032	0.0156	0.0405
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0032	0.0156	0.0113
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0369	0.4303	0.4278
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0833	1	1
Echinococcus granulosus	lipoxygenase domain containing protein	0.0139	0.1477	0.144
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0051	0.0398	0.0924
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0398	0.0924
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0104	0.1041	0.329
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0104	0.1041	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0032	0.0156	0.0113
Loa Loa (eye worm)	hypothetical protein	0.003	0.014	0.0326
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0104	0.1041	1
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.2857
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0.014	0.0949
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.0706	0.1906
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.041	0.1295
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0051	0.0398	0.1257
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.0706	0.1641
Schistosoma mansoni	rab6-interacting	0.0139	0.1477	0.1342
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0032	0.0156	0.0493
Trichomonas vaginalis	calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative	0.0051	0.0398	0.1257
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0318	0.3671	0.3644
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0051	0.0398	0.0356
Brugia malayi	hypothetical protein	0.0139	0.1477	0.4011
Plasmodium falciparum	LCCL domain-containing protein	0.0139	0.1477	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.0032	0.0156	0.0493
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0706	0.0559
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0277	0.3164	0.7354
Schistosoma mansoni	cgmp-dependent 35-cyclic phosphodiesterase	0.007	0.0631	0.0483

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.0794 um	PUBCHEM_BIOASSAY: Total Fluorescence Counterscreen for Inhibitors of the Interaction of Thyroid Hormone Receptor and Steroid Receptor Coregulator 2. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.0119 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	10 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	18.3564 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	44.6684 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	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

ChEMBL: CHEMBL1492931

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1368583