TDR Targets

Basic information

Technical information

TDR Targets ID: 114852
Name: methyl 6,7-dimethoxy-1-oxo-4-(3,4,5-trimethox yphenyl)-2H-isoquinoline-3-carboxylate
MW: 429.42 | Formula: C22H23NO8
H donors: 1 H acceptors: 3 LogP: 3.75 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc2c(O)nc(c(c2cc1OC)c1cc(OC)c(c(c1)OC)OC)C(=O)OC
InChi: 1S/C22H23NO8/c1-26-14-9-12-13(10-15(14)27-2)21(24)23-19(22(25)31-6)18(12)11-7-16(28-3)20(30-5)17(8-11)29-4/h7-10H,1-6H3,(H,23,24)
InChiKey: VCYNRZGDEXCOND-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

6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)-2H-isoquinoline-3-carboxylic acid methyl ester
1-keto-6,7-dimethoxy-4-(3,4,5-trimethoxyphenyl)-2H-isoquinoline-3-carboxylic acid methyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Phosphodiesterase 1	Starlite/ChEMBL	References
Homo sapiens	phosphodiesterase 3A, cGMP-inhibited	Starlite/ChEMBL	References
Canis lupus famiaris	Phosphodiesterase 5A	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma congolense	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	Get druggable targets OG5_128202	All targets in OG5_128202
Trypanosoma congolense	3', 5'-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania mexicana	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania braziliensis	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma brucei	cAMP-specific phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127318	All targets in OG5_127318
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Trypanosoma brucei	cAMP-specific phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	Get druggable targets OG5_128202	All targets in OG5_128202
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Schistosoma japonicum	Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma congolense	cAMP-specific phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	Get druggable targets OG5_132613	All targets in OG5_132613
Cryptosporidium parvum	cGMP phosphodiesterase A4	Get druggable targets OG5_128202	All targets in OG5_128202
Leishmania mexicana	phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Candida albicans	similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Neospora caninum	3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	Get druggable targets OG5_128202	All targets in OG5_128202
Trypanosoma brucei gambiense	3, 5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania infantum	cAMP phosphodiesterase A	Get druggable targets OG5_128202	All targets in OG5_128202
Leishmania infantum	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania mexicana	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania braziliensis	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Loa Loa (eye worm)	PDE1B protein	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132613	All targets in OG5_132613
Toxoplasma gondii	hypothetical protein	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132613	All targets in OG5_132613
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Schistosoma japonicum	Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania braziliensis	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Schistosoma japonicum	expressed protein	Get druggable targets OG5_127318	All targets in OG5_127318
Candida albicans	similar to S. cerevisiae PDE2 (YOR360C) cAMP phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Trypanosoma brucei gambiense	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma brucei gambiense	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Cryptosporidium hominis	cGMP phosphodiesterase A4	Get druggable targets OG5_128202	All targets in OG5_128202
Leishmania donovani	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127318	All targets in OG5_127318
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Leishmania infantum	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Neospora caninum	hypothetical protein	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Neospora caninum	hypothetical protein	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	Get druggable targets OG5_128202	All targets in OG5_128202
Leishmania donovani	phosphodiesterase, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trypanosoma brucei	cAMP phosphodiesterase A, putative	Get druggable targets OG5_128202	All targets in OG5_128202
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_128202	All targets in OG5_128202
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	Get druggable targets OG5_127318	All targets in OG5_127318
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_127318	All targets in OG5_127318

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	Phosphodiesterase 1	535 aa	463 aa	28.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis		0.4241	0.7854	1
Echinococcus multilocularis	tubulin beta 1 chain	0.009	0.0054	0.0068
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.5382	1	1
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.009	0.0054	0.0068
Trypanosoma cruzi	subtilisin peptidase	0.0252	0.0358	1
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0252	0.0358	1
Echinococcus granulosus	neuroendocrine convertase 2	0.3813	0.7051	0.7051
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0253	0.0359	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0358	0.0358
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0073	0.0021	0.0579
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0105	0.0082	0.0082
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Mycobacterium leprae	Possible secreted protease	0.0252	0.0358	0.5
Leishmania major	beta tubulin	0.009	0.0054	0.15
Toxoplasma gondii	subtilisin SUB9	0.0252	0.0358	0.9194
Echinococcus granulosus	Furin 1	0.1498	0.27	0.27
Plasmodium vivax	subtilisin-like protease 1	0.0252	0.0358	1
Echinococcus multilocularis	tubulin subunit beta	0.009	0.0054	0.0068
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Brugia malayi	Will die slowly protein	0.0142	0.0151	0.0151
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	tubulin epsilon chain, putative	0.009	0.0054	0.0086
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0253	0.0359	0.0359
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0252	0.0358	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0101	0.0074	0.2064
Loa Loa (eye worm)	tubulin beta chain	0.009	0.0054	0.0054
Trichomonas vaginalis	tubulin gamma chain, putative	0.009	0.0054	0.0086
Leishmania major	beta tubulin	0.009	0.0054	0.15
Loa Loa (eye worm)	hypothetical protein	0.2419	0.4431	0.4431
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0101	0.0074	0.2064
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0252	0.0358	0.0456
Echinococcus multilocularis	G protein coupled receptor 139	0.0211	0.028	0.0356
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0105	0.0082	0.0082
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0252	0.0358	0.0358
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0054	0.0054
Trichomonas vaginalis	retinoblastoma binding protein, putative	0.0081	0.0035	0.0053
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Toxoplasma gondii	beta-1 tubulin, putative	0.009	0.0054	0.1379
Loa Loa (eye worm)	hypothetical protein	0.0576	0.0966	0.0966
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.1246	0.2226	0.3935
Echinococcus granulosus	protein will die slowly	0.0142	0.0151	0.0151
Echinococcus granulosus	epidermal growth factor receptor	0.0474	0.0774	0.0774
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Brugia malayi	Trypsin family protein	0.0105	0.0082	0.0082
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0357	0.0554	0.0973
Loa Loa (eye worm)	hypothetical protein	0.0105	0.0082	0.0082
Trichomonas vaginalis	conserved hypothetical protein	0.0252	0.0358	0.0625
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0101	0.0074	0.1898
Leishmania major	beta tubulin	0.009	0.0054	0.15
Trichomonas vaginalis	conserved hypothetical protein	0.0252	0.0358	0.0625
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Loa Loa (eye worm)	BEN-1 protein	0.009	0.0054	0.0054
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Leishmania major	beta tubulin	0.009	0.0054	0.15
Schistosoma mansoni	hypothetical protein	0.0142	0.0151	0.0151
Loa Loa (eye worm)	tubulin beta-2A chain	0.009	0.0054	0.0054
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0252	0.0358	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0054	0.0068
Toxoplasma gondii	subtilisin SUB2	0.0252	0.0358	0.9194
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0252	0.0358	0.5
Schistosoma mansoni	retinoblastoma binding protein	0.0081	0.0035	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0035	0.0035
Plasmodium vivax	subtilisin-like protease 2, putative	0.0252	0.0358	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0474	0.0774	0.0774
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.3067	0.5649	1
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Onchocerca volvulus		0.0105	0.0082	0.2277
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Entamoeba histolytica	tubulin family protein	0.009	0.0054	0.5
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	tubulin, putative	0.009	0.0054	0.0086
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0252	0.0358	0.0358
Echinococcus multilocularis	epidermal growth factor receptor	0.0474	0.0774	0.0986
Toxoplasma gondii	subtilisin SUB4	0.0252	0.0358	0.9194
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0096	0.0065	0.0366
Trichomonas vaginalis	hypothetical protein	0.1142	0.203	0.3587
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	conserved hypothetical protein	0.0252	0.0358	0.0625
Leishmania major	beta tubulin	0.009	0.0054	0.15
Echinococcus multilocularis	beta tubulin	0.009	0.0054	0.0068
Leishmania major	beta tubulin	0.009	0.0054	0.15
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0101	0.0074	0.0094
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Echinococcus granulosus	tubulin beta 1 chain	0.009	0.0054	0.0054
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0101	0.0074	0.1898
Trypanosoma cruzi	beta tubulin, putative	0.009	0.0054	0.15
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0096	0.0065	0.1811
Trichomonas vaginalis	conserved hypothetical protein	0.0252	0.0358	0.0625
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0096	0.0065	0.0106
Entamoeba histolytica	tubulin family protein	0.009	0.0054	0.5
Toxoplasma gondii	beta tubulin	0.009	0.0054	0.1379
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0252	0.0358	0.0358
Loa Loa (eye worm)	subtilase	0.0252	0.0358	0.0358
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0096	0.0065	0.0366
Brugia malayi	neuroendocrine convertase 1 precursor	0.4285	0.7938	0.7938
Echinococcus granulosus	membrane bound transcription factor site 1	0.0252	0.0358	0.0358
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Brugia malayi	beta-tubulin, identical	0.009	0.0054	0.0054
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0252	0.0358	0.5
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0054	0.0068
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0101	0.0074	0.0664
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0101	0.0074	0.0074
Loa Loa (eye worm)	WD40 repeat protein	0.0142	0.0151	0.0151
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.3067	0.5649	1
Leishmania major	beta tubulin	0.009	0.0054	0.15
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0054	0.0054
Trichomonas vaginalis	WD repeat domain, putative	0.0142	0.0151	0.0258
Toxoplasma gondii	subtilisin SUB12	0.0269	0.0389	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0252	0.0358	1
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	conserved hypothetical protein	0.0104	0.008	0.0132
Giardia lamblia	Furin precursor putative serine protease	0.1246	0.2226	0.7301
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Trypanosoma brucei	subtilisin peptidase	0.0252	0.0358	1
Toxoplasma gondii	subtilisin SUB1	0.0252	0.0358	0.9194
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0101	0.0074	0.2064
Loa Loa (eye worm)	hypothetical protein	0.0532	0.0883	0.0883
Loa Loa (eye worm)	tubulin beta-1 chain	0.009	0.0054	0.0054
Loa Loa (eye worm)	hypothetical protein	0.05	0.0824	0.0824
Loa Loa (eye worm)	endoprotease bli-4	0.5382	1	1
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0101	0.0074	0.2064
Loa Loa (eye worm)	BEN-1 protein	0.009	0.0054	0.0054
Toxoplasma gondii	subtilisin SUB10	0.0252	0.0358	0.9194
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Plasmodium vivax	subtilisin-like serine protease, putative	0.0252	0.0358	1
Onchocerca volvulus		0.0142	0.0151	0.4208
Echinococcus granulosus	tubulin subunit beta	0.009	0.0054	0.0054
Leishmania major	beta tubulin	0.009	0.0054	0.15
Trichomonas vaginalis	tubulin epsilon chain, putative	0.009	0.0054	0.0086
Schistosoma mansoni	neuropeptide receptor	0.0211	0.028	0.028
Echinococcus multilocularis	beta tubulin	0.009	0.0054	0.0068
Echinococcus granulosus	tubulin beta 4A class IVa	0.009	0.0054	0.0054
Brugia malayi	Subtilase family protein	0.0252	0.0358	0.0358
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0073	0.0021	0.0027
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.1498	0.27	0.27
Toxoplasma gondii	subtilisin SUB8	0.0252	0.0358	0.9194
Plasmodium vivax	tubulin beta chain, putative	0.009	0.0054	0.15
Brugia malayi	Hypothetical WD-repeat protein F21H12.1 in chromosome II	0.0081	0.0035	0.0035
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0054	0.0054
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0096	0.0065	0.0065
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0252	0.0358	0.0358
Plasmodium falciparum	tubulin beta chain	0.009	0.0054	0.15
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.1246	0.2226	0.3935
Echinococcus multilocularis	neuropeptide receptor	0.0211	0.028	0.0356
Echinococcus multilocularis	neuroendocrine convertase 2	0.3813	0.7051	0.8978
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Leishmania major	beta tubulin	0.009	0.0054	0.15
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0252	0.0358	1
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Leishmania major	beta tubulin	0.009	0.0054	0.15
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0096	0.0065	0.0083
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0054	0.0054
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Loa Loa (eye worm)	tubulin beta-4 chain	0.009	0.0054	0.0054
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0054	0.0054
Trichomonas vaginalis	tubulin beta chain, putative	0.009	0.0054	0.0086
Loa Loa (eye worm)	hypothetical protein	0.0105	0.0082	0.0082
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Leishmania major	subtilisin-like serine peptidase	0.0252	0.0358	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1498	0.27	0.4775
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Brugia malayi	Tubulin beta-1 chain	0.009	0.0054	0.0054
Trichomonas vaginalis	tubulin alpha chain, putative	0.009	0.0054	0.0086
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Onchocerca volvulus		0.0252	0.0358	1
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Echinococcus multilocularis	protein will die slowly	0.0142	0.0151	0.0192
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0252	0.0358	0.5
Echinococcus granulosus	beta tubulin	0.009	0.0054	0.0054
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0252	0.0358	0.5
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Plasmodium falciparum	subtilisin-like protease 2	0.0252	0.0358	1
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0252	0.0358	0.5
Giardia lamblia	High cysteine membrane protein Group 2	0.1673	0.3029	1
Brugia malayi	proprotein convertase 2	0.3813	0.7051	0.7051
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.1142	0.203	0.3587
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Loa Loa (eye worm)	proprotein convertase 2	0.1498	0.27	0.27
Toxoplasma gondii	subtilisin SUB5	0.0252	0.0358	0.9194
Toxoplasma gondii	subtilisin SUB7	0.0252	0.0358	0.9194
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0096	0.0065	0.0106
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Leishmania major	beta tubulin	0.009	0.0054	0.15
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Loa Loa (eye worm)	beta-tubulin	0.009	0.0054	0.0054
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0096	0.0065	0.1811
Schistosoma mansoni	tyrosine kinase	0.0474	0.0774	0.0774
Echinococcus granulosus	furin	0.5382	1	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0096	0.0065	0.0065
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Echinococcus multilocularis	wd40 repeat	0.0081	0.0035	0.0045
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Echinococcus granulosus	beta tubulin	0.009	0.0054	0.0054
Leishmania major	beta tubulin	0.009	0.0054	0.15
Trichomonas vaginalis	conserved hypothetical protein	0.0096	0.0065	0.0106
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Leishmania major	beta tubulin	0.009	0.0054	0.15
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.3067	0.5649	0.7192
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Leishmania major	beta tubulin	0.009	0.0054	0.15
Brugia malayi	celfurPC protein	0.4241	0.7854	0.7854
Schistosoma mansoni	tubulin subunit beta	0.009	0.0054	0.0054
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0532	0.0883	0.0883
Trichomonas vaginalis	conserved hypothetical protein	0.0252	0.0358	0.0625
Schistosoma mansoni	furin-1 (S08 family)	0.2567	0.4709	0.4709
Echinococcus granulosus	neuropeptide receptor	0.0211	0.028	0.028
Toxoplasma gondii	beta-tubulin, putative	0.009	0.0054	0.1379
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0253	0.0359	0.0359
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0357	0.0554	0.0554
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0096	0.0065	0.1811
Toxoplasma gondii	subtilisin SUB11	0.0252	0.0358	0.9194
Echinococcus multilocularis	Furin 1	0.1498	0.27	0.3438
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0252	0.0358	0.5
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0096	0.0065	0.0106
Loa Loa (eye worm)	PDE1B protein	0.0253	0.0359	0.0359
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0252	0.0358	0.5
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0252	0.0358	0.0358
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0252	0.0358	0.0358
Leishmania major	beta tubulin	0.009	0.0054	0.15
Plasmodium falciparum	subtilisin-like protease 1	0.0252	0.0358	1
Leishmania major	beta tubulin	0.009	0.0054	0.15
Leishmania major	beta tubulin	0.009	0.0054	0.15
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0253	0.0359	0.0457
Echinococcus granulosus	wd40 repeat	0.0081	0.0035	0.0035
Toxoplasma gondii	hypothetical protein	0.0065	0.0005	0.0135
Trichomonas vaginalis	conserved hypothetical protein	0.0081	0.0035	0.0053
Loa Loa (eye worm)	hypothetical protein	0.5382	1	1
Leishmania major	beta tubulin	0.009	0.0054	0.15
Schistosoma mansoni	hypothetical protein	0.1142	0.203	0.203
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0054	0.0068
Onchocerca volvulus		0.0088	0.0049	0.1368
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0073	0.0021	0.0027
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Brugia malayi	Furin-like cysteine rich region family protein	0.0474	0.0774	0.0774
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.3067	0.5649	0.5649
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Trichomonas vaginalis	conserved hypothetical protein	0.1142	0.203	0.3587
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0252	0.0358	0.0456
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0054	0.0068
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Onchocerca volvulus		0.0105	0.008	0.2243
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0252	0.0358	0.5
Plasmodium falciparum	subtilisin-like protease 3	0.0252	0.0358	1
Toxoplasma gondii	subtilisin SUB6	0.0252	0.0358	0.9194
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0252	0.0358	0.0625
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0054	0.0068

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 900 nM	Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5)	ChEMBL.	11405657
IC50 (binding)	= 900 nM	Inhibitory activity against canine lung Phosphodiesterase 5 (PDE5)	ChEMBL.	11405657
IC50 (binding)	> 10000 nM	Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)	ChEMBL.	11405657
IC50 (binding)	> 10000 nM	Inhibitory activity against canine heart Phosphodiesterase 3 (PDE3)	ChEMBL.	11405657
IC50 (binding)	> 10000 nM	Inhibitory activity against rat heart Phosphodiesterase 1(PDE1)	ChEMBL.	11405657
IC50 (binding)	> 10000 nM	Inhibitory activity against canine heart Phosphodiesterase 3 (PDE3)	ChEMBL.	11405657

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: CHEMBL305427
PubChem: 11122848

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 114852