TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 344.298 | Formula: C14H17N4NaO5
H donors: 1 H acceptors: 6 LogP: 0.78 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=C1N2[C@@H]([C@H]1[C@H](c1nnn(c1)C)O)OC(=C2C(=O)[O-])C(C)(C)C.[Na+]
InChi: 1S/C14H18N4O5.Na/c1-14(2,3)10-8(13(21)22)18-11(20)7(12(18)23-10)9(19)6-5-17(4)16-15-6;/h5,7,9,12,19H,1-4H3,(H,21,22);/q;+1/p-1/t7-,9-,12+;/m0./s1
InChiKey: DHISLSCRTLKEKY-ZLYHIZNPSA-M

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

No curated genes were found associated with this compound

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
Brugia malayi	Probable exocyst complex component Sec5	0.0072	0.0223	0.0223
Echinococcus granulosus	neurogenic locus notch protein 4	0.0139	0.0635	0.0635
Onchocerca volvulus	Putative cubilin	0.0139	0.0635	0.0449
Echinococcus granulosus	transcription factor collier	0.0072	0.0223	0.0223
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0067	0.0192	0.011
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	hypothetical protein	0.0164	0.0785	0.0785
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Echinococcus granulosus	semaphorin 1A	0.0164	0.0785	0.0785
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	fibrillin 1	0.0364	0.2014	0.2014
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	Tolloid protein 1	0.0364	0.2014	0.2014
Loa Loa (eye worm)	hypothetical protein	0.0364	0.2014	0.2014
Onchocerca volvulus		0.0392	0.2179	0.2024
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0191	0.0951	0.0951
Echinococcus granulosus	transmembrane protease serine 3	0.0067	0.0195	0.0195
Brugia malayi	Trypsin family protein	0.0067	0.0195	0.0195
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus multilocularis	hexokinase type 2	0.167	1	1
Loa Loa (eye worm)	hypothetical protein	0.0392	0.2179	0.2179
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Brugia malayi	notch-like transmembrane receptor	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Toxoplasma gondii	hexokinase	0.167	1	1
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0039	0.0023	0.0023
Brugia malayi	DNA-binding protein LAG-1	0.0072	0.0223	0.0223
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Schistosoma mansoni	laminin gamma-3 chain	0.0139	0.0635	0.0635
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0049	0.0083	0.3698
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.0139	0.0635	0.0635
Echinococcus multilocularis	fibropellin Ia	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Leishmania major	hexokinase, putative	0.167	1	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	Cadherin domain containing protein	0.0139	0.0635	0.0635
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0067	0.0195	0.0195
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Loa Loa (eye worm)	Notch2	0.0139	0.0635	0.0635
Trypanosoma brucei	hexokinase	0.167	1	1
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hexokinase type II	0.167	1	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0223	0.0223
Onchocerca volvulus		0.0139	0.0635	0.0449
Schistosoma mansoni	plexin	0.0228	0.1179	0.1179
Loa Loa (eye worm)	hexokinase	0.0517	0.2946	0.2946
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus granulosus	enteropeptidase	0.0067	0.0195	0.0195
Schistosoma mansoni	hexokinase	0.167	1	1
Loa Loa (eye worm)	low-density lipoprotein receptor repeat class B containing protein	0.0364	0.2014	0.2014
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Trichomonas vaginalis	Clan MA, family M8, leishmanolysin-like metallopeptidase	0.0072	0.0223	1
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Schistosoma mansoni	slit	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Schistosoma mansoni	septate junction protein	0.0139	0.0635	0.0635
Brugia malayi	Plexin repeat family protein	0.0392	0.2179	0.2179
Loa Loa (eye worm)	multiple epidermal growth factor-like domains 6	0.0364	0.2014	0.2014
Treponema pallidum	hexokinase (hxk)	0.167	1	0.5
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Schistosoma mansoni	semaphorin 5-related	0.0164	0.0785	0.0785
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Onchocerca volvulus		0.0139	0.0635	0.0449
Brugia malayi	Hexokinase family protein	0.0517	0.2946	0.2946
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.0067	0.0192	0.0192
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0036	0.0008	0.0342
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0039	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	laminin	0.0364	0.2014	0.2014
Echinococcus multilocularis	transmembrane protease serine 3	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0049	0.0086	0.3872
Loa Loa (eye worm)	notch protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0531	0.3033	0.3033
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0228	0.1179	0.1179
Trichomonas vaginalis	conserved hypothetical protein	0.0049	0.0086	0.3872
Onchocerca volvulus		0.0164	0.0785	0.0602
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus granulosus	Mastin	0.0067	0.0195	0.0195
Echinococcus granulosus	glycoprotein Antigen 5	0.0067	0.0195	0.0195
Schistosoma mansoni	hypothetical protein	0.0067	0.0195	0.0195
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0039	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0223	0.0223
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Brugia malayi	hypothetical protein	0.0067	0.0195	0.0195
Brugia malayi	Muscle positioning protein 4	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0364	0.2014	0.2014
Trichomonas vaginalis	Clan MA, family M8, leishmanolysin-like metallopeptidase	0.0072	0.0223	1
Schistosoma mansoni	hypothetical protein	0.0072	0.0223	0.0223
Echinococcus granulosus	hexokinase	0.167	1	1
Echinococcus multilocularis	hexokinase	0.167	1	1
Brugia malayi	Cadherin domain containing protein	0.0139	0.0635	0.0635
Echinococcus granulosus	hexokinase	0.167	1	1
Echinococcus multilocularis	plexin a4	0.0463	0.2618	0.2618
Echinococcus multilocularis	exocyst complex component 2	0.0072	0.0223	0.0223
Brugia malayi	IPT/TIG domain containing protein	0.0072	0.0223	0.0223
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0067	0.0192	0.011
Brugia malayi	Fibulin-1 precursor	0.0364	0.2014	0.2014
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Loa Loa (eye worm)	plexin A	0.0463	0.2618	0.2618
Entamoeba histolytica	hexokinase 2	0.167	1	1
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus granulosus	neurogenic locus protein delta	0.0139	0.0635	0.0635
Schistosoma mansoni	subfamily M12A unassigned peptidase (M12 family)	0.0364	0.2014	0.2014
Schistosoma mansoni	hypothetical protein	0.0228	0.1179	0.1179
Brugia malayi	Calcium binding EGF domain containing protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Brugia malayi	Trypsin-like protease protein 5	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0223	0.0223
Trypanosoma cruzi	hexokinase, putative	0.167	1	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0067	0.0192	0.8609
Brugia malayi	Delta serrate ligand family protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Loa Loa (eye worm)	hypothetical protein	0.0364	0.2014	0.2014
Schistosoma mansoni	hypothetical protein	0.0164	0.0785	0.0785
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0067	0.0192	0.011
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0067	0.0195	0.0195
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Echinococcus multilocularis	protein jagged 2	0.0139	0.0635	0.0635
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Onchocerca volvulus	Hexokinase homolog	0.1048	0.6193	0.6118
Echinococcus granulosus	slit 2 protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Onchocerca volvulus		0.0139	0.0635	0.0449
Echinococcus multilocularis	Mastin	0.0067	0.0195	0.0195
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Echinococcus multilocularis	slit 2 protein	0.0139	0.0635	0.0635
Onchocerca volvulus	Arrow homolog	0.0364	0.2014	0.1855
Echinococcus multilocularis	neurogenic locus notch protein	0.0139	0.0635	0.0635
Brugia malayi	plexin A	0.0463	0.2618	0.2618
Brugia malayi	Trypsin family protein	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0531	0.3033	0.3033
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Loa Loa (eye worm)	trypsin family protein	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Brugia malayi	Sema domain containing protein	0.0164	0.0785	0.0785
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0223	0.0223
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Echinococcus multilocularis	semaphorin 5B	0.0164	0.0785	0.0785
Echinococcus granulosus	plexin a4	0.0463	0.2618	0.2618
Toxoplasma gondii	calcium binding egf domain-containing protein	0.0364	0.2014	0.1944
Loa Loa (eye worm)	sema domain-containing protein	0.0164	0.0785	0.0785
Echinococcus multilocularis	glycoprotein Antigen 5	0.0067	0.0195	0.0195
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0049	0.0083	0.3698
Schistosoma mansoni	hypothetical protein	0.0164	0.0785	0.0785
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Echinococcus multilocularis	hexokinase	0.167	1	1
Echinococcus granulosus	neural cadherin	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.1139	0.6752	0.6752
Schistosoma mansoni	egf-like domain protein	0.0364	0.2014	0.2014
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Echinococcus multilocularis	notch	0.0139	0.0635	0.0635
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Plasmodium falciparum	hexokinase	0.167	1	0.5
Echinococcus granulosus	laminin	0.0364	0.2014	0.2014
Schistosoma mansoni	fibrocystin l	0.0072	0.0223	0.0223
Schistosoma mansoni	hypothetical protein	0.0072	0.0223	0.0223
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.0067	0.0192	0.0192
Schistosoma mansoni	plexin	0.0392	0.2179	0.2179
Giardia lamblia	High cysteine protein	0.0139	0.0635	0.5
Brugia malayi	Trypsin family protein	0.0067	0.0195	0.0195
Echinococcus granulosus	semaphorin 5B	0.0164	0.0785	0.0785
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	Clan MA, family M8, leishmanolysin-like metallopeptidase	0.0072	0.0223	1
Toxoplasma gondii	calcium binding egf domain-containing protein	0.0364	0.2014	0.1944
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0191	0.0951	0.0951
Onchocerca volvulus		0.167	1	1
Onchocerca volvulus		0.0139	0.0635	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0364	0.2014	0.2014
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	Hexokinase family protein	0.167	1	1
Plasmodium vivax	hexokinase, putative	0.167	1	0.5
Trichomonas vaginalis	Clan MA, family M8, leishmanolysin-like metallopeptidase	0.0072	0.0223	1
Brugia malayi	Calcium binding EGF domain containing protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Echinococcus granulosus	Tolloid protein 1	0.0364	0.2014	0.2014
Brugia malayi	GCC2 and GCC3 family protein	0.0139	0.0635	0.0635
Schistosoma mansoni	hypothetical protein	0.0067	0.0195	0.0195
Toxoplasma gondii	EGF family domain-containing protein	0.0139	0.0635	0.0554
Echinococcus multilocularis	neurogenic locus notch protein	0.0139	0.0635	0.0635
Entamoeba histolytica	hexokinase 1	0.167	1	1
Echinococcus multilocularis	neural cadherin	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	neurogenic locus protein delta	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Brugia malayi	hypothetical protein	0.0164	0.0785	0.0785
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Onchocerca volvulus		0.1048	0.6193	0.6118
Onchocerca volvulus	Neurogenic locus notch homolog	0.0139	0.0635	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus granulosus	delta-like protein 1	0.0139	0.0635	0.0635
Entamoeba histolytica	tyrosin kinase, putative	0.0091	0.034	0.012
Echinococcus granulosus	hexokinase type 2	0.167	1	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Echinococcus granulosus	exocyst complex component 2	0.0072	0.0223	0.0223
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Schistosoma mansoni	voltage-gated potassium channel	0.0043	0.0045	0.0045
Onchocerca volvulus	Slit protein homolog	0.0139	0.0635	0.0449
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0067	0.0195	0.0195
Echinococcus multilocularis	neurogenic locus notch protein 4	0.0139	0.0635	0.0635
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hexokinase	0.167	1	1
Trichomonas vaginalis	Clan MA, family M8, leishmanolysin-like metallopeptidase	0.0072	0.0223	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Brugia malayi	Trypsin family protein	0.0067	0.0195	0.0195
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0036	0.0008	0.0342
Echinococcus granulosus	hexokinase	0.167	1	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.0067	0.0192	0.0192
Trichomonas vaginalis	conserved hypothetical protein	0.0049	0.0086	0.3872
Onchocerca volvulus		0.167	1	1
Schistosoma mansoni	notch	0.0139	0.0635	0.0635
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0067	0.0195	0.0195
Echinococcus granulosus	neurogenic locus notch protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hexokinase	0.1048	0.6193	0.6193
Echinococcus granulosus	protein jagged 2	0.0139	0.0635	0.0635
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Echinococcus granulosus	notch	0.0139	0.0635	0.0635
Echinococcus multilocularis	protein jagged 1	0.0139	0.0635	0.0635
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Onchocerca volvulus	Neurogenic locus notch protein homolog	0.0139	0.0635	0.0449
Loa Loa (eye worm)	PDE1B protein	0.0191	0.0951	0.0951
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	Calcium binding EGF domain containing protein	0.0364	0.2014	0.2014
Echinococcus granulosus	neurogenic locus notch protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0223	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Brugia malayi	hexokinase type II	0.0531	0.3033	0.3033
Brugia malayi	Hexokinase family protein	0.1048	0.6193	0.6193
Echinococcus granulosus	protein jagged 2	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Brugia malayi	hypothetical protein	0.0164	0.0785	0.0785
Loa Loa (eye worm)	bone morphogenetic protein 1b	0.0364	0.2014	0.2014
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0067	0.0192	0.8609
Brugia malayi	Sema domain containing protein	0.0164	0.0785	0.0785
Loa Loa (eye worm)	sema domain-containing protein	0.0164	0.0785	0.0785
Echinococcus granulosus	fibropellin Ia	0.0139	0.0635	0.0635
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0067	0.0192	0.8609
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Trypanosoma cruzi	hexokinase, putative	0.167	1	1
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus granulosus	protein jagged 1	0.0139	0.0635	0.0635
Echinococcus multilocularis	protein jagged 1	0.0139	0.0635	0.0635
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0067	0.0192	0.8609
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	hexokinase	0.167	1	1
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Brugia malayi	Low-density lipoprotein receptor repeat class B containing protein	0.0364	0.2014	0.2014
Onchocerca volvulus		0.0139	0.0635	0.0449
Schistosoma mansoni	hypothetical protein	0.0139	0.0635	0.0635
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Mycobacterium ulcerans	hypothetical protein	0.0067	0.0195	0.5
Leishmania major	hexokinase, putative	0.167	1	1
Trypanosoma brucei	hexokinase	0.167	1	1
Trypanosoma brucei	hexokinase, putative	0.167	1	1
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Entamoeba histolytica	protein kinase domain containing protein	0.0091	0.034	0.012
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0191	0.0951	0.0951
Schistosoma mansoni	cell polarity protein	0.0139	0.0635	0.0635
Schistosoma mansoni	voltage-gated potassium channel	0.0043	0.0045	0.0045
Loa Loa (eye worm)	hexokinase	0.167	1	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0039	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0364	0.2014	0.2014
Echinococcus multilocularis	transcription factor collier	0.0072	0.0223	0.0223
Onchocerca volvulus		0.167	1	1
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0191	0.0951	0.0951
Schistosoma mansoni	cercarial elastase (S01 family)	0.0067	0.0195	0.0195
Echinococcus multilocularis	neurogenic locus protein delta	0.0139	0.0635	0.0635
Echinococcus multilocularis	fat cadherin tumor suppressor	0.0139	0.0635	0.0635
Echinococcus granulosus	protein jagged 1	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0785	0.0785
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0195	0.0195
Brugia malayi	Calcium binding EGF domain containing protein	0.0139	0.0635	0.0635
Brugia malayi	EGF-like domain containing protein	0.0139	0.0635	0.0635
Echinococcus multilocularis	enteropeptidase	0.0067	0.0195	0.0195

Activities

Activity type	Activity value	Assay description	Source	Reference
Relative protection (binding)	= 1.3	Protective effect tested by the inhibition of Staphylococcus aureus beta-lactamase relative to clavulanic acid	ChEMBL.	No reference
Relative protection (binding)	= 1.8	Protective effect of compound was tested by the inhibition of Proteus vulgaris beta-lactamase relative to clavulanic acid as 1	ChEMBL.	No reference
Relative protection (binding)	= 1.3	Protective effect tested by the inhibition of Staphylococcus aureus beta-lactamase relative to clavulanic acid	ChEMBL.	No reference
Relative protection (binding)	= 1.8	Protective effect of compound was tested by the inhibition of Proteus vulgaris beta-lactamase relative to clavulanic acid as 1	ChEMBL.	No reference
T1/2 (ADMET)	= 7 hr	T1/2 (phosphate buffer pH 7.0 @ 28 degree C)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL70288

Bibliographic References

No literature references available for this target.

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Detailed information for compound 116580