TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 357.189 | Formula: C15H14Cl2N2O4
H donors: 2 H acceptors: 3 LogP: 2.64 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: OC[C@@H]1O[C@@H](C[C@@H]1O)n1c2cc(Cl)c(cc2c(c1OC)C#N)Cl
InChi: 1S/C15H14Cl2N2O4/c1-22-15-8(5-18)7-2-9(16)10(17)3-11(7)19(15)14-4-12(21)13(6-20)23-14/h2-3,12-14,20-21H,4,6H2,1H3/t12?,13-,14-/m1/s1
InChiKey: NYWIOWPXTRAKDN-ILMHWDKJSA-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

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
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0022	0.0396	0.1415
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0057	0.1694	0.1756
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0087	0.2776	0.2386
Brugia malayi	G-protein coupled receptor	0.0057	0.1694	0.1488
Brugia malayi	ORL1-like opioid receptor	0.0057	0.1694	0.1488
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Toxoplasma gondii	Adenosine/AMP deaminase domain-containing protein	0.0269	0.9447	1
Leishmania major	AMP deaminase, putative,adenosine monophosphate deaminase-like protein	0.0088	0.28	0.2689
Toxoplasma gondii	AMP deaminase	0.0088	0.28	0.2964
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0022	0.0396	0.0377
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.003	0.0687	0.0727
Loa Loa (eye worm)	hypothetical protein	0.0181	0.6235	0.6235
Brugia malayi	Serotonin receptor	0.0057	0.1694	0.1488
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0047	0.1326	0.1404
Echinococcus multilocularis	neuropeptide receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	tm gpcr rhodopsin	0.0057	0.1694	0.1756
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0148	0.5017	0.529
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0047	0.1326	0.1365
Brugia malayi	larval opioid receptor	0.0057	0.1694	0.1488
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0148	0.5017	0.4894
Brugia malayi	Cytochrome P450 family protein	0.0029	0.0656	0.0425
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Entamoeba histolytica	adenosine deaminase, putative	0.0269	0.9447	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0057	0.1694	0.1756
Toxoplasma gondii	LsmAD domain-containing protein	0.0028	0.06	0.0635
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	amine GPCR	0.0057	0.1694	0.1793
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.06	0.0269
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0057	0.1694	0.1793
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0021	0.0355	0.0333
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.5
Echinococcus multilocularis	neuropeptide receptor A26	0.0057	0.1694	0.1756
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0057	0.1694	0.1756
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0022	0.0396	0.0159
Toxoplasma gondii	Adenosine/AMP deaminase domain-containing protein	0.0269	0.9447	1
Onchocerca volvulus	Adenosine deaminase homolog	0.0269	0.9447	1
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0022	0.0396	0.0377
Brugia malayi	neuropeptide F receptor	0.0057	0.1694	0.1488
Entamoeba histolytica	AMP deaminase, putative	0.0088	0.28	0.2964
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0057	0.1694	0.1756
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0148	0.5017	0.529
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0057	0.1694	0.1488
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Echinococcus multilocularis	serotonin receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	biogenic amine 5HT receptor	0.0057	0.1694	0.1756
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	1
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0021	0.0355	0.0355
Schistosoma mansoni	neuropeptide F-like receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0161	0.5497	0.5819
Schistosoma mansoni	neuropeptide receptor	0.0057	0.1694	0.1793
Echinococcus granulosus	g protein coupled receptor	0.0057	0.1694	0.1756
Echinococcus multilocularis	muscleblind protein	0.0152	0.5152	0.5434
Plasmodium vivax	ataxin-2 like protein, putative	0.0028	0.06	0.0635
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	G protein coupled receptor 139	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0011	0.00000000033317	0.00000000033317
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2663
Echinococcus granulosus	g-protein coupled receptor	0.0057	0.1694	0.1756
Giardia lamblia	Sgs1 DNA helicase, putative	0.0022	0.0396	0.0499
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0057	0.1694	0.1756
Trypanosoma brucei	AMP deaminase, putative	0.0088	0.28	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Trypanosoma cruzi	AMP deaminase 2, putative	0.0088	0.28	1
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0057	0.1694	0.1488
Echinococcus multilocularis	orexin receptor type 2	0.0057	0.1694	0.1756
Brugia malayi	RE15519p	0.0057	0.1694	0.1488
Entamoeba histolytica	recQ family helicase, putative	0.0022	0.0396	0.0419
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0057	0.1678	0.1455
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0021	0.0355	0.0376
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0148	0.5017	0.5311
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	amine GPCR	0.0057	0.1694	0.1793
Brugia malayi	Cytochrome P450 family protein	0.0029	0.0668	0.0437
Loa Loa (eye worm)	hypothetical protein	0.0168	0.5749	0.5749
Schistosoma mansoni	DNA helicase recq1	0.0022	0.0396	0.0419
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0057	0.1694	0.1756
Brugia malayi	putative neuropeptide receptor NPR1	0.0057	0.1694	0.1488
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0087	0.2776	0.2939
Trypanosoma cruzi	AMP deaminase, putative	0.0088	0.28	1
Brugia malayi	hypothetical protein	0.0028	0.06	0.0367
Loa Loa (eye worm)	hypothetical protein	0.0152	0.5152	0.5152
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2908
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Schistosoma mansoni	adenosine deaminase-related	0.0269	0.9447	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0057	0.1694	0.1694
Echinococcus granulosus	orexin receptor type 2	0.0057	0.1694	0.1756
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0022	0.0396	0.0377
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0087	0.2776	0.2939
Brugia malayi	putative neuropeptide receptor	0.0057	0.1694	0.1488
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0259	0.0259
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0057	0.1694	0.1756
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0057	0.1678	0.1132
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0057	0.1694	0.1488
Echinococcus multilocularis	g-protein coupled receptor	0.0057	0.1694	0.1756
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0022	0.0396	0.0419
Loa Loa (eye worm)	TYRA-2 protein	0.0057	0.1694	0.1694
Leishmania major	hypothetical protein, conserved	0.0028	0.06	0.0269
Echinococcus multilocularis	neuropeptide Y receptor	0.0057	0.1694	0.1756
Trypanosoma cruzi	adenosine monophosphate deaminase, putative	0.0088	0.28	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0057	0.1694	0.1756
Leishmania major	adenine aminohydrolase	0.0269	0.9447	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Brugia malayi	G-protein coupled receptor	0.0057	0.1694	0.1488
Echinococcus multilocularis	bloom syndrome protein	0.0022	0.0396	0.0377
Loa Loa (eye worm)	hypothetical protein	0.0087	0.2776	0.2776
Schistosoma mansoni	neuropeptide receptor	0.0057	0.1694	0.1793
Trypanosoma brucei	adenosine monophosphate deaminase, putative	0.0088	0.28	1
Giardia lamblia	Histone acetyltransferase GCN5	0.0043	0.1181	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	acetyltransferase	0.0161	0.5497	0.5497
Brugia malayi	acetyltransferase, GNAT family protein	0.0161	0.5497	0.5386
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Schistosoma mansoni	hypothetical protein	0.0012	0.0042	0.0044
Echinococcus granulosus	neuropeptides capa receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	neuropeptide FF receptor 2	0.0057	0.1694	0.1756
Echinococcus granulosus	g protein coupled receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0181	0.6235	0.6235
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0047	0.1326	0.1068
Loa Loa (eye worm)	melatonin receptor type 1A	0.0057	0.1694	0.1694
Echinococcus granulosus	hypothetical protein	0.0057	0.1694	0.1756
Schistosoma mansoni	growth hormone secretagogue receptor	0.0057	0.1694	0.1793
Echinococcus granulosus	neuropeptide Y receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	AMP deaminase 2	0.0088	0.28	0.2932
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Onchocerca volvulus	AMP deaminase 2 homolog	0.0088	0.28	0.1426
Entamoeba histolytica	AMP deaminase, putative	0.0088	0.28	0.2964
Brugia malayi	G protein-coupled receptor F59B2.13	0.0057	0.1694	0.1488
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0057	0.1694	0.1756
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2939
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2663
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Brugia malayi	Melatonin receptor type 1A	0.0057	0.1694	0.1488
Echinococcus multilocularis	serotonin receptor	0.0057	0.1694	0.1756
Echinococcus multilocularis	neuropeptide s receptor	0.0057	0.1694	0.1756
Trypanosoma brucei	AMP deaminase, putative	0.0088	0.28	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	dro:myosuppressin receptor	0.0057	0.1694	0.1756
Treponema pallidum	adenosine deaminase	0.0269	0.9447	1
Loa Loa (eye worm)	hypothetical protein	0.0181	0.6235	0.6235
Echinococcus multilocularis	neuropeptides capa receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	hypothetical protein	0.0188	0.6497	0.6877
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0396	0.0396
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	biogenic amine receptor	0.0057	0.1694	0.1793
Leishmania major	adenosine monophosphate deaminase, putative,AMP deaminase, putative	0.0088	0.28	0.2689
Plasmodium vivax	adenosine deaminase, putative	0.0269	0.9447	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0148	0.5017	0.5311
Trichomonas vaginalis	adenosine deaminase, putative	0.0269	0.9447	1
Echinococcus granulosus	7tm_1 domain containing protein	0.0057	0.1694	0.1756
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0022	0.0396	0.0419
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	biogenic amine receptor	0.0057	0.1694	0.1793
Echinococcus granulosus	g protein coupled receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	neuropeptide receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Brugia malayi	Dopamine receptor protein 2	0.0057	0.1694	0.1488
Echinococcus granulosus	adenosine deaminase	0.0269	0.9447	1
Schistosoma mansoni	adenoreceptor	0.0057	0.1694	0.1793
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0057	0.1694	0.1793
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0284	1	1
Echinococcus multilocularis	somatostatin receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	G protein coupled receptor 139	0.0057	0.1694	0.1756
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	histamine h1 receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0028	0.06	0.06
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0021	0.0355	0.0376
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0057	0.1694	0.1756
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0022	0.0396	0.0159
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0021	0.0355	0.1268
Plasmodium falciparum	adenosine deaminase	0.0269	0.9447	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0057	0.1694	0.1694
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Onchocerca volvulus		0.0168	0.5749	0.523
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0047	0.1326	0.1404
Schistosoma mansoni	amine GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0057	0.1694	0.1756
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0057	0.1678	0.174
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	hypothetical protein	0.0057	0.1694	0.1793
Trypanosoma cruzi	AMP deaminase, putative	0.0088	0.28	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.06	0.0269
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Leishmania major	AMP deaminase, putative	0.0088	0.28	0.2689
Schistosoma mansoni	DNA helicase recq5	0.0022	0.0396	0.0419
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	neuropeptides capa receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0181	0.6235	0.6235
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0022	0.0396	0.0045
Echinococcus granulosus	tm gpcr rhodopsin	0.0057	0.1694	0.1756
Brugia malayi	Dopamine receptor protein 1	0.0057	0.1694	0.1488
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0057	0.1694	0.1793
Echinococcus multilocularis	sex peptide receptor	0.0057	0.1694	0.1756
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0161	0.5497	0.5801
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Trichomonas vaginalis	adenosine deaminase, putative	0.0269	0.9447	1
Loa Loa (eye worm)	G-protein coupled receptor	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	fmrfamide receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	geminin	0.0188	0.6497	0.6863
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	neuropeptide receptor	0.0057	0.1694	0.1756
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0355	0.1268
Echinococcus granulosus	neuropeptide s receptor	0.0057	0.1694	0.1756
Brugia malayi	Muscleblind-like protein	0.0152	0.5152	0.5032
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0057	0.1694	0.1793
Leishmania major	hypothetical protein, conserved	0.0088	0.28	0.2689
Schistosoma mansoni	hypothetical protein	0.0057	0.1694	0.1793
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.003	0.0687	0.0727
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0022	0.0396	0.0396
Schistosoma mansoni	hypothetical protein	0.0188	0.6497	0.6877
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0022	0.0396	0.0045
Schistosoma mansoni	amine GPCR	0.0057	0.1694	0.1793
Echinococcus multilocularis	fmrfamide receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	biogenic amine 5HT receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	neuropeptide f receptor 76f	0.0057	0.1694	0.1793
Schistosoma mansoni	hypothetical protein	0.0057	0.1694	0.1793
Echinococcus multilocularis	g protein coupled receptor	0.0057	0.1694	0.1756
Toxoplasma gondii	exonuclease III APE	0.0021	0.0355	0.0376
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Brugia malayi	Serotonin receptor	0.0057	0.1694	0.1488
Brugia malayi	exodeoxyribonuclease III family protein	0.0021	0.0355	0.0116
Trypanosoma cruzi	AMP deaminase, putative	0.0088	0.28	1
Trichomonas vaginalis	DNA helicase recq, putative	0.0022	0.0396	0.0045
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0355	0.0376
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0148	0.5017	0.5311
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Brugia malayi	adenosine monophosphate deaminase	0.0088	0.28	0.2622
Toxoplasma gondii	hypothetical protein	0.003	0.0687	0.0727
Schistosoma mansoni	biogenic amine receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0269	0.9447	0.9447
Trypanosoma brucei	PAB1-binding protein , putative	0.0028	0.06	0.1002
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.06	0.2142
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.06	0.2142
Brugia malayi	Bloom's syndrome protein homolog	0.0022	0.0396	0.0159
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0057	0.1694	0.1756
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0087	0.2776	0.2939
Entamoeba histolytica	adenosine deaminase, putative	0.0269	0.9447	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	AMP deaminase	0.0088	0.28	0.28
Echinococcus granulosus	neuropeptide receptor A26	0.0057	0.1694	0.1756
Trypanosoma cruzi	AMP deaminase, putative	0.0088	0.28	1
Brugia malayi	sulfakinin receptor protein	0.0057	0.1694	0.1488
Schistosoma mansoni	AMP deaminase	0.0088	0.28	0.2964
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0057	0.1694	0.1756
Onchocerca volvulus		0.0088	0.28	0.1426
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	opsin-like receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0057	0.1694	0.1694
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Trichomonas vaginalis	DNA helicase recq, putative	0.0022	0.0396	0.0045
Loa Loa (eye worm)	neuropeptide F receptor	0.0057	0.1694	0.1694
Schistosoma mansoni	opsin-like receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	cytochrome P450 family protein	0.0029	0.0656	0.0656
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2663
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0057	0.1694	0.1488
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0057	0.1694	0.1756
Echinococcus granulosus	serotonin receptor	0.0057	0.1694	0.1756
Mycobacterium ulcerans	adenosine deaminase	0.0269	0.9447	1
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0047	0.1326	0.1404
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0087	0.2776	0.2908
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0057	0.1694	0.1793
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0057	0.1678	0.1455
Echinococcus granulosus	dro:myosuppressin receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0057	0.1694	0.1793
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0022	0.0396	0.0169
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Trypanosoma brucei	AMP deaminase, putative	0.0088	0.28	1
Schistosoma mansoni	peptidase Clp (S14 family)	0.0087	0.2776	0.2939
Trypanosoma cruzi	cytochrome P450, putative	0.0029	0.0656	0.2343
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0029	0.0656	0.0331
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0148	0.5017	0.529
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0057	0.1694	0.1488
Trypanosoma cruzi	AMP deaminase, putative	0.0088	0.28	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0148	0.5017	0.529
Mycobacterium leprae	Probable adenosine deaminase Add (ADENOSINE AMINOHYDROLASE)	0.0269	0.9447	1
Brugia malayi	Dopamine receptor	0.0057	0.1694	0.1488
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0021	0.0355	0.0333
Schistosoma mansoni	neuropeptide receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Schistosoma mansoni	neuropeptide F-like receptor	0.0057	0.1694	0.1793
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Schistosoma mansoni	adenosine deaminase	0.0269	0.9447	1
Loa Loa (eye worm)	RecQ helicase	0.0022	0.0396	0.0396
Echinococcus multilocularis	muscleblind protein 1	0.0152	0.5152	0.5434
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0057	0.1694	0.1793
Echinococcus granulosus	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0057	0.1694	0.1756
Trypanosoma cruzi	adenosine monophosphate deaminase-like protein, putative	0.0088	0.28	1
Plasmodium vivax	adenosine/AMP deaminase, putative	0.0088	0.28	0.2964
Leishmania major	cytochrome p450-like protein	0.0029	0.0656	0.0331
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Plasmodium falciparum	histone acetyltransferase GCN5	0.0043	0.1181	0.0909
Echinococcus granulosus	tm gpcr rhodopsin	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0022	0.0396	0.0377
Loa Loa (eye worm)	hypothetical protein	0.0152	0.5152	0.5152
Brugia malayi	Adenosine/AMP deaminase family protein	0.0269	0.9447	0.9433
Echinococcus multilocularis	neuropeptide receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	adenosine deaminase	0.0269	0.9447	1
Mycobacterium tuberculosis	Probable adenosine deaminase Add (adenosine aminohydrolase)	0.0269	0.9447	1
Echinococcus multilocularis	fmrfamide receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	g protein coupled receptor	0.0057	0.1694	0.1756
Brugia malayi	G protein-coupled receptor	0.0057	0.1694	0.1488
Echinococcus multilocularis	AMP deaminase 2	0.0088	0.28	0.2932
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0057	0.1694	0.1756
Brugia malayi	AKH receptor	0.0057	0.1694	0.1488
Brugia malayi	GnHR receptor homolog	0.0057	0.1694	0.1488
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0047	0.1326	0.1068
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0057	0.1694	0.1793
Brugia malayi	hypothetical protein	0.0168	0.5749	0.5644
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Trypanosoma cruzi	cytochrome P450, putative	0.0029	0.0656	0.2343
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	hypothetical protein	0.0057	0.1694	0.1793
Loa Loa (eye worm)	G-protein coupled receptor	0.0057	0.1694	0.1694
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0057	0.1694	0.1793
Brugia malayi	Cytochrome P450 family protein	0.0029	0.0656	0.0425
Echinococcus multilocularis	geminin	0.0188	0.6497	0.6863
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	ap endonuclease	0.0021	0.0355	0.0376
Brugia malayi	Probable ClpP-like protease	0.0087	0.2776	0.2598
Loa Loa (eye worm)	cytochrome P450 family protein	0.0029	0.0656	0.0656
Schistosoma mansoni	neuropeptide receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0088	0.28	0.28
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0057	0.1694	0.1756
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.003	0.0687	0.0365
Echinococcus granulosus	allatostatin A receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	ap endonuclease	0.0021	0.0355	0.0376
Echinococcus granulosus	neuropeptides capa receptor	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	bloom syndrome protein	0.0022	0.0396	0.0377
Brugia malayi	hypothetical protein	0.0057	0.1694	0.1488
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0148	0.5017	0.5017
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Entamoeba histolytica	acetyltransferase, GNAT family	0.0043	0.1181	0.125
Trypanosoma brucei	cytochrome P450, putative	0.0029	0.0656	0.1231
Brugia malayi	neuropeptide F receptor	0.0057	0.1694	0.1488
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0157	0.5332	0.5624
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	neuropeptide Y receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0057	0.1694	0.1793
Schistosoma mansoni	myosin xvIII	0.0057	0.1694	0.1793
Loa Loa (eye worm)	neuropeptide F receptor	0.0057	0.1694	0.1694
Echinococcus granulosus	muscleblind protein	0.0152	0.5152	0.5434
Echinococcus multilocularis	g protein coupled receptor	0.0057	0.1694	0.1756
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0057	0.1694	0.1488
Echinococcus granulosus	sex peptide receptor	0.0057	0.1694	0.1756
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0057	0.1694	0.1756
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0057	0.1694	0.1756
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0057	0.1694	0.1756
Schistosoma mansoni	amine GPCR	0.0057	0.1694	0.1793
Trichomonas vaginalis	DNA helicase recq1, putative	0.0022	0.0396	0.0045
Loa Loa (eye worm)	cytochrome P450 family protein	0.0029	0.0668	0.0668
Echinococcus multilocularis	allatostatin A receptor	0.0057	0.1694	0.1756
Plasmodium falciparum	AMP deaminase, putative	0.0088	0.28	0.2689
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.0022	0.0396	0.0045
Echinococcus granulosus	peptidase Clp S14 family	0.0057	0.1678	0.174
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0057	0.1694	0.1793
Loa Loa (eye worm)	hypothetical protein	0.0057	0.1694	0.1694
Echinococcus granulosus	somatostatin receptor	0.0057	0.1694	0.1756
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0057	0.1694	0.1793
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0087	0.2776	0.5
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0057	0.1694	0.1756
Leishmania major	AMP deaminase, putative,amp deaminase-like protein	0.0088	0.28	0.2689
Echinococcus granulosus	7TM GPCR rhodopsin	0.0057	0.1694	0.1756
Loa Loa (eye worm)	CYP4Cod1	0.0029	0.0656	0.0656
Schistosoma mansoni	opsin-like receptor	0.0057	0.1694	0.1793

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 68 uM	Inhibitory concentration required against human cytomegalovirus (HCMV) expressed in HFF cells was determined by plaque reduction assay	ChEMBL.	15509176
IC50 (functional)	= 90 uM	Inhibitory concentration required against herpes simplex virus type-1 (HSV-1) expressed in BSC-1 cells was determined by ELISA assay	ChEMBL.	15509176
IC50 (functional)	> 100 uM	Cytotoxicity produced in stationary HFF cells was determined by microscopic inspection of uninfected cells	ChEMBL.	15509176
IC50 (functional)	> 100 uM	Cytotoxicity of the compound against KB cells was determined by crystal violet staining and spectrophotometric quantitation of dye eluted from stained cells	ChEMBL.	15509176

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: 414549

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 326450