TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 540.537 | Formula: C27H27F3N6O3
H donors: 2 H acceptors: 4 LogP: 4.49 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: O=C(Nc1ccc2c(c1)c(C)nc(n2)N1CCC(CC1)N1CCNC1=O)/C=C/c1ccc(cc1)OC(F)(F)F
InChi: 1S/C27H27F3N6O3/c1-17-22-16-19(33-24(37)9-4-18-2-6-21(7-3-18)39-27(28,29)30)5-8-23(22)34-25(32-17)35-13-10-20(11-14-35)36-15-12-31-26(36)38/h2-9,16,20H,10-15H2,1H3,(H,31,38)(H,33,37)/b9-4+
InChiKey: ZIFGIPYSZZOZKD-RUDMXATFSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	melanin-concentrating hormone receptor 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

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
Schistosoma mansoni	cgmp-dependent 35-cyclic phosphodiesterase	0.0121	0.0789	0.0789
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0057	0.0297	0.0745
Schistosoma mansoni	TRABID protein (C64 family)	0.0469	0.3466	0.3466
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Echinococcus multilocularis	SWI:SNF matrix associated	0.132	1	1
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0121	0.0789	0.2182
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Giardia lamblia	hypothetical protein	0.0034	0.0118	0.2963
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Chlamydia trachomatis	DNA topoisomerase I	0.132	1	0.5
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	conserved hypothetical protein	0.0087	0.053	0.049
Mycobacterium leprae	conserved hypothetical protein	0.0087	0.053	0.5
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus granulosus	ring finger protein 113a	0.0024	0.0042	0.0042
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Schistosoma mansoni	lamin	0.0031	0.01	0.01
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0469	0.3466	0.3466
Schistosoma mansoni	hypothetical protein	0.004	0.0164	0.0164
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0469	0.3466	1
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0057	0.0297	0.0745
Trypanosoma cruzi	cAMP-specific phosphodiesterase, putative	0.0034	0.0118	0.0221
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Plasmodium vivax	hypothetical protein, conserved	0.0087	0.053	0.049
Schistosoma mansoni	fusion	0.0469	0.3466	0.3466
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Onchocerca volvulus		0.0469	0.3466	0.3438
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0057	0.0297	0.0745
Toxoplasma gondii	Zn-finger in Ran binding protein and others domain-containing protein	0.0469	0.3466	0.3438
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0469	0.3466	1
Schistosoma mansoni	hypothetical protein	0.0024	0.0042	0.0042
Giardia lamblia	Kinase, NEK	0.0024	0.0046	0.0156
Chlamydia trachomatis	SWIB complex protein	0.132	1	0.5
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0034	0.0118	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0118	0.0118
Brugia malayi	SWIB/MDM2 domain containing protein	0.132	1	1
Schistosoma mansoni	cellular tumor antigen P53	0.0048	0.0229	0.0229
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0118	0.0118
Schistosoma mansoni	camp-specific cyclic nucleotide phosphodiesterase	0.0034	0.0118	0.0118
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Onchocerca volvulus		0.0469	0.3466	0.3438
Trypanosoma brucei	protein kinase, putative	0.0057	0.0297	0.0745
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0057	0.0297	0.0745
Echinococcus granulosus	zinc finger protein Ran binding	0.0469	0.3466	0.3466
Brugia malayi	Zinc finger protein 183 homolog	0.0024	0.0042	0.0042
Trypanosoma cruzi	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0469	0.3466	1
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Echinococcus multilocularis	E3 ubiquitin protein ligase LRSAM1	0.0024	0.0042	0.0042
Schistosoma mansoni	hypothetical protein	0.0056	0.0291	0.0291
Plasmodium falciparum	phosphodiesterase delta, putative	0.0034	0.0118	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0469	0.3466	0.3466
Loa Loa (eye worm)	calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase	0.0034	0.0118	0.0118
Plasmodium vivax	cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Plasmodium vivax	SWIB/MDM2 domain-containing protein, putative	0.132	1	1
Echinococcus multilocularis	SWI:SNF matrix associated	0.132	1	1
Brugia malayi	intermediate filament protein	0.0031	0.01	0.01
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Leishmania major	hypothetical protein, conserved	0.0469	0.3466	1
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0121	0.0789	0.0789
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Plasmodium vivax	phosphodiesterase gamma, putative	0.0034	0.0118	0.0076
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0034	0.0118	0.0118
Echinococcus multilocularis	ring finger protein 170	0.0024	0.0042	0.0042
Brugia malayi	YY1-associated factor 2	0.0469	0.3466	0.3466
Echinococcus granulosus	ring finger protein 170	0.0024	0.0042	0.0042
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus granulosus	cAMP and cAMP inhibited cGMP 3'5' cyclic	0.1076	0.8125	0.8125
Echinococcus multilocularis	RING finger protein 185	0.0024	0.0042	0.0042
Entamoeba histolytica	hypothetical protein	0.0042	0.0181	1
Echinococcus multilocularis	lamin dm0	0.0031	0.01	0.01
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0057	0.0297	0.0297
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Echinococcus multilocularis		0.0024	0.0042	0.0042
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus granulosus	cell growth regulator with ring finger domain	0.0024	0.0042	0.0042
Echinococcus multilocularis	musashi	0.0031	0.01	0.01
Giardia lamblia	Hypothetical protein	0.0034	0.0118	0.2963
Onchocerca volvulus	Ubiquitin thioesterase ZRANB1 homolog	0.0469	0.3466	0.3438
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.0087	0.053	0.5
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0034	0.0118	0.0118
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Echinococcus granulosus	RING finger protein 185	0.0024	0.0042	0.0042
Echinococcus multilocularis	mitogen activated protein kinase	0.0057	0.0297	0.0297
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0297	0.0256
Schistosoma mansoni	hypothetical protein	0.132	1	1
Toxoplasma gondii	ran binding protein	0.0469	0.3466	0.3438
Giardia lamblia	Kinase, CMGC MAPK	0.0057	0.0297	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0469	0.3466	1
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0297	0.0256
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0034	0.0118	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0469	0.3466	0.3466
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Schistosoma mansoni	zinc finger protein	0.0469	0.3466	0.3466
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus multilocularis	high affinity cAMP specific 3',5' cyclic	0.0034	0.0118	0.0118
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0469	0.3466	0.3466
Onchocerca volvulus		0.0031	0.01	0.0058
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.0087	0.053	0.5
Schistosoma mansoni	hypothetical protein	0.0042	0.0181	0.0181
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0057	0.0297	0.0745
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0469	0.3466	0.3466
Echinococcus granulosus	E3 ubiquitin protein ligase Bre1	0.0024	0.0042	0.0042
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0121	0.0789	0.2182
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0034	0.0118	0.0118
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0034	0.0118	0.0076
Onchocerca volvulus		0.0031	0.01	0.0058
Echinococcus granulosus	Zinc finger RanBP2 type	0.0469	0.3466	0.3466
Schistosoma mansoni	rnf5	0.0024	0.0042	0.0042
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0042	0.0181	0.0181
Echinococcus multilocularis	high affinity cgmp specific 3' 5' cyclic	0.0034	0.0118	0.0118
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Echinococcus multilocularis	RING finger and transmembrane domain containing protein	0.0024	0.0042	0.0042
Leishmania major	hypothetical protein, conserved	0.0469	0.3466	1
Brugia malayi	hypothetical protein	0.0042	0.0181	0.0181
Plasmodium falciparum	zinc finger Ran-binding domain-containing protein 2, putative	0.0469	0.3466	0.3438
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0221
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0057	0.0297	0.0256
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0118	0.0076
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.132	1	1
Schistosoma mansoni	survival motor neuron protein	0.0056	0.0291	0.0291
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Loa Loa (eye worm)	brahma associated protein	0.132	1	1
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus multilocularis	E3 ubiquitin protein ligase mib1	0.0024	0.0042	0.0042
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0057	0.0297	0.0297
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0034	0.0118	0.0118
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.0034	0.0118	0.2963
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.132	1	1
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0229	0.0229
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Schistosoma mansoni	brg-1 associated factor	0.132	1	1
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative	0.1076	0.8125	0.8125
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.132	1	1
Schistosoma mansoni	mind bomb	0.0024	0.0042	0.0042
Onchocerca volvulus		0.0469	0.3466	0.3438
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0057	0.0297	0.0745
Echinococcus granulosus	Nuclear pore complex protein Nup153	0.0469	0.3466	0.3466
Brugia malayi	latrophilin 2 splice variant baaae	0.004	0.0164	0.0164
Trichomonas vaginalis	conserved hypothetical protein	0.0087	0.053	0.049
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Echinococcus granulosus	mitogen activated protein kinase	0.0057	0.0297	0.0297
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0305	0.0305
Echinococcus granulosus	Upstream activation factor subunit UAF30	0.132	1	1
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0469	0.3466	1
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0056	0.0291	0.0291
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0058	0.0305	0.0305
Schistosoma mansoni	peter pan-related	0.0024	0.0042	0.0042
Entamoeba histolytica	hypothetical protein	0.0042	0.0181	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0042	0.0181	0.0181
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0034	0.0118	0.0221
Echinococcus granulosus	mitogen activated protein kinase 3	0.0057	0.0297	0.0297
Loa Loa (eye worm)	intermediate filament protein	0.0031	0.01	0.01
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Trypanosoma brucei	hypothetical protein, conserved	0.0034	0.0118	0.0221
Giardia lamblia	Kinase	0.0024	0.0046	0.0156
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.132	1	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0034	0.0118	0.0118
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0034	0.0118	0.0118
Echinococcus granulosus	survival motor neuron protein 1	0.0276	0.1976	0.1976
Onchocerca volvulus		0.0048	0.0229	0.0188
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0121	0.0789	0.075
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0034	0.0118	0.0118
Loa Loa (eye worm)	RING finger protein 20	0.0024	0.0042	0.0042
Echinococcus multilocularis	lamin	0.0031	0.01	0.01
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0121	0.0789	0.2182
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0058	0.0305	0.0305
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.132	1	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0134	0.0886	0.0886
Loa Loa (eye worm)	hypothetical protein	0.0276	0.1976	0.1976
Brugia malayi	Intermediate filament tail domain containing protein	0.0031	0.01	0.01
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0058	0.0305	0.0305
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trypanosoma cruzi	hypothetical protein, conserved	0.0469	0.3466	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Schistosoma mansoni	transcription factor LCR-F1	0.0042	0.0181	0.0181
Leishmania major	hypothetical protein, conserved	0.0034	0.0118	0.0221
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Schistosoma mansoni	lamin	0.0031	0.01	0.01
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Trypanosoma cruzi	cyclic nucleotide phosphodiesterase	0.0034	0.0118	0.0221
Schistosoma mansoni	serine/threonine protein kinase	0.0057	0.0297	0.0297
Plasmodium falciparum	GAF domain-related protein, putative	0.0087	0.053	0.049
Trichomonas vaginalis	conserved hypothetical protein	0.0087	0.053	0.049
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0297	0.0256
Leishmania major	cAMP-specific phosphodiesterase, putative	0.0034	0.0118	0.0221
Echinococcus multilocularis	tumor protein p63	0.0329	0.2391	0.2391
Trypanosoma brucei	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0469	0.3466	1
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0034	0.0118	0.0118
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Entamoeba histolytica	hypothetical protein	0.0042	0.0181	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0469	0.3466	1
Echinococcus granulosus	lamin	0.0031	0.01	0.01
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0034	0.0118	0.0221
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Leishmania major	hypothetical protein, conserved	0.0034	0.0118	0.0221
Loa Loa (eye worm)	hypothetical protein	0.1042	0.7866	0.7866
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0118	0.0118
Leishmania major	hypothetical protein, conserved	0.0469	0.3466	1
Schistosoma mansoni	hypothetical protein	0.0024	0.0042	0.0042
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Schistosoma mansoni	inhibitor of apoptosis 1 diap1	0.0024	0.0042	0.0042
Schistosoma mansoni	hypothetical protein	0.0469	0.3466	0.3466
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Echinococcus multilocularis	cAMP and cAMP inhibited cGMP 3',5' cyclic	0.1076	0.8125	0.8125
Onchocerca volvulus		0.0056	0.0291	0.0249
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Echinococcus multilocularis	zinc finger protein Ran binding	0.0469	0.3466	0.3466
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0121	0.0789	0.0789
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Onchocerca volvulus		0.132	1	1
Brugia malayi	brahma associated protein 60 kDa	0.132	1	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Schistosoma mansoni	hypothetical protein	0.0024	0.0042	0.0042
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trypanosoma cruzi	hypothetical protein, conserved	0.0469	0.3466	1
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0908	0.6839	0.6839
Trichomonas vaginalis	conserved hypothetical protein	0.0121	0.0789	0.075
Loa Loa (eye worm)	hypothetical protein	0.0031	0.01	0.01
Brugia malayi	Neuralized family protein	0.0024	0.0042	0.0042
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus granulosus	high affinity cAMP specific 3'5' cyclic	0.0034	0.0118	0.0118
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0034	0.0118	0.0221
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0034	0.0118	0.0118
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.0087	0.053	0.5
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0034	0.0118	0.0221
Schistosoma mansoni	zinc finger protein	0.0024	0.0042	0.0042
Leishmania major	hypothetical protein, conserved	0.0469	0.3466	1
Echinococcus granulosus	SWI:SNF matrix associated	0.132	1	1
Plasmodium vivax	hypothetical protein, conserved	0.132	1	1
Echinococcus multilocularis	ring and YY1 binding protein	0.0469	0.3466	0.3466
Trypanosoma brucei	hypothetical protein, conserved	0.0469	0.3466	1
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0469	0.3466	0.3466
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0034	0.0118	0.0221
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Echinococcus granulosus	E3 ubiquitin protein ligase mib1	0.0024	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0469	0.3466	0.3466
Brugia malayi	Hypothetical RING finger protein C16C10.7 in chromosome III	0.0024	0.0042	0.0042
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.0034	0.0118	0.0118
Schistosoma mansoni	hypothetical protein	0.132	1	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Toxoplasma gondii	SWIB/MDM2 domain-containing protein	0.132	1	1
Brugia malayi	RING zinc finger protein	0.0024	0.0042	0.0042
Brugia malayi	MAP kinase sur-1	0.0057	0.0297	0.0297
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Echinococcus multilocularis	E3 ubiquitin protein ligase MYLIP	0.0024	0.0042	0.0042
Echinococcus granulosus	intermediate filament protein	0.0031	0.01	0.01
Giardia lamblia	Kinase, NEK	0.0024	0.0046	0.0156
Echinococcus granulosus	E3 ubiquitin protein ligase LRSAM1	0.0024	0.0042	0.0042
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0121	0.0789	0.2182
Echinococcus multilocularis	ring finger protein 113a	0.0024	0.0042	0.0042
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Schistosoma mansoni	hypothetical protein	0.132	1	1
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0034	0.0118	0.0118
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trypanosoma cruzi	WLM domain containing protein, putative	0.0469	0.3466	1
Schistosoma mansoni	RNA binding protein	0.0469	0.3466	0.3466
Echinococcus multilocularis	survival motor neuron protein 1	0.0276	0.1976	0.1976
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0121	0.0789	0.2182
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0031	0.01	0.01
Echinococcus multilocularis	E3 ubiquitin protein ligase Bre1	0.0024	0.0042	0.0042
Echinococcus multilocularis	Nuclear pore complex protein Nup153	0.0469	0.3466	0.3466
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0221
Trypanosoma brucei	mitochondrial RNA binding complex 1 subunit	0.0469	0.3466	1
Mycobacterium ulcerans	putative regulatory protein	0.0087	0.053	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0024	0.0046	0.0046
Echinococcus multilocularis	Zinc finger, RanBP2 type	0.0469	0.3466	0.3466
Brugia malayi	hypothetical protein	0.0276	0.1976	0.1976
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0469	0.3466	0.3466
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Brugia malayi	Zinc finger, C2H2 type family protein	0.0024	0.0042	0.0042
Brugia malayi	RING finger protein 20	0.0024	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.004	0.0164	0.0164
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Echinococcus granulosus	tumor protein p63	0.0329	0.2391	0.2391
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Schistosoma mansoni	ring finger protein 151	0.0024	0.0042	0.0042
Toxoplasma gondii	hypothetical protein	0.0087	0.053	0.049
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0121	0.0789	0.0789
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0121	0.0789	0.075
Trypanosoma brucei	cAMP-specific phosphodiesterase, putative	0.0034	0.0118	0.0221
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.0034	0.0118	0.0118
Onchocerca volvulus		0.0469	0.3466	0.3438
Echinococcus granulosus	ring and YY1 binding protein	0.0469	0.3466	0.3466
Echinococcus granulosus	E3 ubiquitin protein ligase MYLIP	0.0024	0.0042	0.0042
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Loa Loa (eye worm)	MH2 domain-containing protein	0.0134	0.0886	0.0886
Entamoeba histolytica	hypothetical protein	0.0042	0.0181	1
Loa Loa (eye worm)	hypothetical protein	0.0121	0.0789	0.0789
Loa Loa (eye worm)	hypothetical protein	0.0469	0.3466	0.3466
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0121	0.0789	0.0789
Loa Loa (eye worm)	hypothetical protein	0.0955	0.7194	0.7194
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Toxoplasma gondii	GAF domain-containing protein	0.0087	0.053	0.049
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0118	0.0221
Brugia malayi	hypothetical protein	0.0024	0.0042	0.0042
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0121	0.0789	0.075
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0042	0.0042
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Trichomonas vaginalis	calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Brugia malayi	MH2 domain containing protein	0.0134	0.0886	0.0886
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0121	0.0789	0.075
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0034	0.0118	0.0076
Echinococcus granulosus	E3 ubiquitin protein ligase RNF146	0.0024	0.0042	0.0042
Echinococcus granulosus	high affinity cgmp specific 3' 5' cyclic	0.0034	0.0118	0.0118
Schistosoma mansoni	peter pan-related	0.0024	0.0042	0.0042
Toxoplasma gondii	hypothetical protein	0.0087	0.053	0.049
Trypanosoma brucei	hypothetical protein, conserved	0.0469	0.3466	1
Plasmodium falciparum	phosphodiesterase gamma, putative	0.0034	0.0118	0.0076
Trypanosoma cruzi	WLM domain containing protein, putative	0.0469	0.3466	1
Leishmania major	hypothetical protein, conserved	0.0469	0.3466	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Trichomonas vaginalis	CMGC family protein kinase	0.0057	0.0297	0.0256
Trichomonas vaginalis	conserved hypothetical protein	0.132	1	1
Loa Loa (eye worm)	RiNg Finger protein family member	0.0024	0.0042	0.0042
Echinococcus multilocularis	SWI:SNF matrix associated	0.132	1	1
Mycobacterium ulcerans	putative regulatory protein	0.0087	0.053	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0087	0.053	0.049
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0034	0.0118	0.0076
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.0034	0.0118	0.0076
Brugia malayi	B-box zinc finger family protein	0.0024	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0096	0.0096
Echinococcus granulosus	RING finger and transmembrane domain containing protein	0.0024	0.0042	0.0042
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0057	0.0297	0.0745
Loa Loa (eye worm)	PDE1B protein	0.0034	0.0118	0.0118
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0034	0.0118	0.0118
Toxoplasma gondii	hypothetical protein	0.0087	0.053	0.049
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0034	0.0118	0.0076
Schistosoma mansoni	intermediate filament proteins	0.0031	0.01	0.01
Echinococcus granulosus	lamin dm0	0.0031	0.01	0.01

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 31 nM	Antagonist activity at human recombinant MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH-induced IP3 accumulation response preincubated for 10 mins prior MCH peptide-stimulation measured after 45 mins by IP3-SPA-YSI assay	ChEMBL.	22497763
IC50 (binding)	= 66 nM	Displacement of [125-I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by scintillation proximity assay	ChEMBL.	22497763
Inhibition (binding)	= 45 %	Inhibition of human ERG expressed in HEK293 cells at 3 uM by voltage clamp electrophysiology assay	ChEMBL.	22497763
Stability (ADMET)	= 89 %	Metabolic stability in mouse liver microsomes assessed as compound remaining at 30 mins	ChEMBL.	22497763

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: CHEMBL2017752

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1642952