TDR Targets

Basic information

Technical information

TDR Targets ID: 104236
Name: 2-[4-cyano-4-(3-cyclopentyloxy-4-ethoxyphenyl )piperidin-1-yl]-N-hydroxyacetamide
MW: 387.473 | Formula: C21H29N3O4
H donors: 2 H acceptors: 3 LogP: 2.39 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1ccc(cc1OC1CCCC1)C1(C#N)CCN(CC1)CC(=O)NO
InChi: 1S/C21H29N3O4/c1-2-27-18-8-7-16(13-19(18)28-17-5-3-4-6-17)21(15-22)9-11-24(12-10-21)14-20(25)23-26/h7-8,13,17,26H,2-6,9-12,14H2,1H3,(H,23,25)
InChiKey: XHHHLXUOGDNSNR-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

2-[4-cyano-4-[3-(cyclopentoxy)-4-ethoxy-phenyl]-1-piperidyl]ethanehydroxamic acid
2-[4-cyano-4-[3-(cyclopentoxy)-4-ethoxyphenyl]-1-piperidinyl]ethanehydroxamic acid
2-[4-cyano-4-(3-cyclopentyloxy-4-ethoxy-phenyl)piperidin-1-yl]-N-hydroxy-ethanamide
2-[4-cyano-4-[3-(cyclopentoxy)-4-ethoxy-phenyl]piperidino]ethanehydroxamic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	phosphodiesterase 4B, cAMP-specific		References
Homo sapiens	phosphodiesterase 4C, cAMP-specific		References
Homo sapiens	phosphodiesterase 4A, cAMP-specific		References
Homo sapiens	phosphodiesterase 4D, cAMP-specific	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	Get druggable targets OG5_128242	All targets in OG5_128242
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma japonicum	cAMP-specific 3',5'-cyclic phosphodiesterase 4D, putative	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma japonicum	cAMP-specific 3',5'-cyclic phosphodiesterase 4D, putative	Get druggable targets OG5_128242	All targets in OG5_128242
Cryptosporidium hominis	hypothetical protein	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma japonicum	cAMP-specific 3',5'-cyclic phosphodiesterase, isoform F, putative	Get druggable targets OG5_128242	All targets in OG5_128242
Neospora caninum	cAMP-specific phosphodiesterase, putative	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma japonicum	cAMP-specific 3',5'-cyclic phosphodiesterase 4C, putative	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Cryptosporidium parvum	membrane associated HD superfamily cyclic nucleotide phosphodiesterase domain containing protein	Get druggable targets OG5_128242	All targets in OG5_128242
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	Get druggable targets OG5_128242	All targets in OG5_128242
Schistosoma japonicum	IPR002073,3'5'-cyclic nucleotide phosphodiesterase,domain-containing	Get druggable targets OG5_128242	All targets in OG5_128242
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	Get druggable targets OG5_128242	All targets in OG5_128242

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
Leishmania major	hypothetical protein, conserved	0.0054	0.0078	0.5
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0449	0.1534	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0057	0.0057
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0447	0.1525	0.1509
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0463	0.1588	0.5
Plasmodium falciparum	phosphodiesterase gamma, putative	0.0054	0.0078	0.5
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0054	0.0078	0.5
Loa Loa (eye worm)	norepinephrine transporter	0.0149	0.0428	0.0428
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0463	0.1588	0.1572
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	PDE1B protein	0.0054	0.0078	0.0078
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0392	0.1324	0.1308
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.0078	0.0434
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.0078	0.0434
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0054	0.0078	0.5
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0428	0.0428
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0054	0.0078	0.0077
Schistosoma mansoni	camp-specific cyclic nucleotide phosphodiesterase	0.0054	0.0078	0.0077
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0054	0.0078	0.5
Echinococcus granulosus	acetylcholinesterase	0.2743	1	1
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0463	0.1588	0.1587
Leishmania major	hypothetical protein, conserved	0.0054	0.0078	0.5
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0054	0.0078	0.5
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0054	0.0078	0.5
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0038	0.0019	0.0018
Echinococcus granulosus	para nitrobenzyl esterase	0.0463	0.1588	0.1572
Onchocerca volvulus		0.0463	0.1588	1
Loa Loa (eye worm)	hypothetical protein	0.2743	1	1
Loa Loa (eye worm)	acetylcholinesterase 1	0.2743	1	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0149	0.0428	0.0428
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Onchocerca volvulus		0.0463	0.1588	1
Schistosoma mansoni	hypothetical protein	0.0166	0.049	0.0489
Echinococcus multilocularis	cAMP and cAMP inhibited cGMP 3',5' cyclic	0.0054	0.0078	0.0059
Echinococcus multilocularis	geminin	0.0166	0.049	0.0472
Onchocerca volvulus		0.0463	0.1588	1
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0447	0.1525	0.1509
Echinococcus multilocularis	neuroligin	0.0463	0.1588	0.1572
Treponema pallidum	sodium- and chloride- dependent transporter	0.0149	0.0428	0.5
Schistosoma mansoni	cgmp-dependent 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Echinococcus multilocularis	acetylcholinesterase	0.2743	1	1
Loa Loa (eye worm)	serotonin transporter b	0.0149	0.0428	0.0428
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	carboxylesterase	0.0463	0.1588	0.1588
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0078	0.0078
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0054	0.0078	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0057	0.0057
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0054	0.0078	0.5
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Leishmania major	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.5
Echinococcus multilocularis	high affinity cgmp specific 3' 5' cyclic	0.0054	0.0078	0.0059
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0463	0.1588	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Schistosoma mansoni	gliotactin	0.0463	0.1588	0.1587
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Brugia malayi	Carboxylesterase family protein	0.0463	0.1588	0.1587
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Schistosoma mansoni	sodium/chloride dependent transporter	0.0149	0.0428	0.0428
Echinococcus granulosus	geminin	0.0166	0.049	0.0472
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0054	0.0078	0.5
Echinococcus multilocularis	para nitrobenzyl esterase	0.0463	0.1588	0.1572
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0038	0.0019	0.0019
Plasmodium falciparum	phosphodiesterase delta, putative	0.0054	0.0078	0.5
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	carboxylesterase	0.0463	0.1588	0.1588
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0054	0.0078	0.0059
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.0447	0.1525	1
Loa Loa (eye worm)	carboxylesterase	0.2743	1	1
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Trichomonas vaginalis	calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0447	0.1525	0.1509
Echinococcus granulosus	carboxylesterase 5A	0.2743	1	1
Schistosoma mansoni	BC026374 protein (S09 family)	0.0463	0.1588	0.1587
Loa Loa (eye worm)	hypothetical protein	0.2743	1	1
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0054	0.0078	0.0059
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0054	0.0078	0.5
Schistosoma mansoni	voltage-gated potassium channel	0.0042	0.0032	0.0031
Brugia malayi	hypothetical protein	0.0463	0.1588	0.1587
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0463	0.1588	0.1572
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0054	0.0078	0.0077
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	BC026374 protein S09 family	0.0463	0.1588	0.1572
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0054	0.0078	0.0077
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0054	0.0078	0.0059
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0054	0.0078	0.0059
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0078	0.0078
Trichomonas vaginalis	spcc417.12 protein, putative	0.0463	0.1588	1
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0054	0.0078	0.0059
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0054	0.0078	0.0077
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0054	0.0078	0.5
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0463	0.1588	0.1587
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0463	0.1588	0.1572
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0054	0.0078	0.0059
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0054	0.0078	0.0077
Plasmodium vivax	phosphodiesterase gamma, putative	0.0054	0.0078	0.5
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative	0.0054	0.0078	0.0077
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	0.0392	0.1324	0.1324
Echinococcus multilocularis	serotonin transporter	0.0149	0.0428	0.041
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0392	0.1324	0.1324
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Trypanosoma brucei	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.5
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase	0.0054	0.0078	0.0078
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Brugia malayi	Carboxylesterase family protein	0.0463	0.1588	0.1587
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0428	0.0428
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Schistosoma mansoni	acetylcholinesterase	0.0463	0.1588	0.1587
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0447	0.1525	0.1525
Echinococcus multilocularis	high affinity cAMP specific 3',5' cyclic	0.0054	0.0078	0.0059
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Schistosoma mansoni	hypothetical protein	0.0166	0.049	0.0489
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.0078	0.0434
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Echinococcus granulosus	acetylcholinesterase	0.2743	1	1
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	serotonin transporter	0.0149	0.0428	0.041
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0463	0.1588	0.5
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	high affinity cgmp specific 3' 5' cyclic	0.0054	0.0078	0.0059
Brugia malayi	Carboxylesterase family protein	0.0463	0.1588	0.1587
Loa Loa (eye worm)	hypothetical protein	0.0447	0.1525	0.1525
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0392	0.1324	0.1308
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0057	0.0087	0.0064
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0463	0.1588	0.1587
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0054	0.0078	0.5
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Trypanosoma cruzi	cyclic nucleotide phosphodiesterase	0.0054	0.0078	0.5
Brugia malayi	Carboxylesterase family protein	0.2743	1	1
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0054	0.0078	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Trypanosoma cruzi	hypothetical protein, conserved	0.0054	0.0078	0.5
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0057	0.0057
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0463	0.1588	0.5
Onchocerca volvulus		0.0463	0.1588	1
Brugia malayi	Carboxylesterase family protein	0.0463	0.1588	0.1587
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.2743	1	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0078	0.0078
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0428	0.0428
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0054	0.0078	0.5
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0054	0.0078	0.5
Trypanosoma brucei	hypothetical protein, conserved	0.0054	0.0078	0.5
Echinococcus granulosus	neuroligin	0.0463	0.1588	0.1572
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0054	0.0078	0.0077
Echinococcus granulosus	cAMP and cAMP inhibited cGMP 3'5' cyclic	0.0054	0.0078	0.0059
Trypanosoma cruzi	cAMP-specific phosphodiesterase, putative	0.0054	0.0078	0.5
Echinococcus multilocularis	acetylcholinesterase	0.2743	1	1
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0149	0.0428	0.0428
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0447	0.1525	0.1509
Schistosoma mansoni	voltage-gated potassium channel	0.0042	0.0032	0.0031
Mycobacterium ulcerans	carboxylesterase, LipT	0.0463	0.1588	0.5
Plasmodium vivax	cyclic nucleotide phosphodiesterase, putative	0.0054	0.0078	0.5
Onchocerca volvulus		0.0463	0.1588	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0057	0.0057
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0463	0.1588	0.1587
Echinococcus granulosus	high affinity cAMP specific 3'5' cyclic	0.0054	0.0078	0.0059
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0149	0.0428	0.0428
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0054	0.0078	0.0434
Echinococcus multilocularis	carboxylesterase 5A	0.2743	1	1
Loa Loa (eye worm)	hypothetical protein	0.0463	0.1588	0.1588

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 6.2 nM	Inhibition of phosphodiesterase 4 (PDE4) prepared from human U937 cells	ChEMBL.	14684329
IC50 (binding)	= 6.2 nM	Inhibition of phosphodiesterase 4 (PDE4) prepared from human U937 cells	ChEMBL.	14684329
ID50 (functional)	= 0.7 mg kg-1	Inhibition of LPS-induced TNF-alpha production in rats 0.5 hr after peroral administration	ChEMBL.	14684329

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.

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External resources for this compound

ChEMBL: CHEMBL63028
PubChem: 10134821

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 104236