TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 305.537 | Formula: C7H15BrClN2O2P
H donors: 1 H acceptors: 1 LogP: 0.9 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: ClCCN1CCCO[P@@]1(=O)NCCBr
InChi: 1S/C7H15BrClN2O2P/c8-2-4-10-14(12)11(6-3-9)5-1-7-13-14/h1-7H2,(H,10,12)/t14-/m0/s1
InChiKey: ZJVAVRRLTFVZIP-AWEZNQCLSA-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
Loa Loa (eye worm)	thioredoxin reductase	0.0048	0.0421	0.0457
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	neuropeptide f receptor 76f	0.008	0.0866	0.0852
Brugia malayi	MAP kinase sur-1	0.0051	0.0473	0.0515
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	serotonin receptor	0.008	0.0866	0.0909
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0172	0.0167
Trypanosoma brucei	trypanothione reductase	0.0048	0.0421	0.8918
Echinococcus multilocularis	geminin	0.0168	0.2084	0.2211
Schistosoma mansoni	microtubule-associated protein tau	0.0697	0.9372	0.9371
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.008	0.0866	0.0852
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.008	0.0866	0.0909
Echinococcus granulosus	fmrfamide receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	dro:myosuppressin receptor	0.008	0.0866	0.0909
Brugia malayi	Adenylate and Guanylate cyclase catalytic domain containing protein	0.0107	0.1243	0.1383
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0121	0.1432	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0016	0.033
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.008	0.0866	0.0909
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	lamin	0.0054	0.0507	0.0525
Schistosoma mansoni	myosin xvIII	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	hypothetical protein	0.0168	0.2084	0.2072
Onchocerca volvulus		0.0358	0.4704	1
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0473	0.1527
Trypanosoma brucei	protein kinase, putative	0.0051	0.0473	1
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0107	0.1243	0.1229
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	allatostatin A receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.008	0.0866	0.0958
Echinococcus multilocularis	neuropeptide Y receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	neuropeptide F receptor	0.008	0.0866	0.0958
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0051	0.0473	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0108	0.0104
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	hypothetical protein	0.008	0.0866	0.0852
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Brugia malayi	cytoplasmic intermediate filament protein	0.0029	0.0161	0.0164
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0107	0.1243	0.1229
Echinococcus granulosus	microtubule associated protein 2	0.0697	0.9372	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.008	0.0866	0.0852
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.008	0.0866	0.0909
Echinococcus granulosus	neuropeptide Y receptor	0.008	0.0866	0.0909
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.008	0.0866	0.0909
Schistosoma mansoni	amine GPCR	0.008	0.0866	0.0852
Echinococcus multilocularis	somatostatin receptor	0.008	0.0866	0.0909
Brugia malayi	G protein-coupled receptor F59B2.13	0.008	0.0866	0.0958
Plasmodium falciparum	glutathione reductase	0.0048	0.0421	1
Echinococcus granulosus	nischarin	0.0355	0.4661	0.4966
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.008	0.0866	0.0958
Brugia malayi	Thioredoxin reductase	0.0048	0.0421	0.0457
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0662	0.8891	0.8889
Schistosoma mansoni	serine/threonine protein kinase	0.0051	0.0473	0.0458
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	hypothetical protein	0.0347	0.4549	0.5108
Brugia malayi	Intermediate filament tail domain containing protein	0.0054	0.0507	0.0553
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	biogenic amine 5HT receptor	0.008	0.0866	0.0909
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0107	0.1243	0.1229
Onchocerca volvulus	Neuropeptide F receptor homolog	0.008	0.0866	0.1531
Echinococcus multilocularis	neuropeptide FF receptor 2	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.0336	0.4399	0.4939
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0122	0.012
Schistosoma mansoni	neuropeptide receptor	0.008	0.0866	0.0852
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	mitogen activated protein kinase 3	0.0051	0.0473	0.0488
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.008	0.0866	0.0909
Schistosoma mansoni	adenoreceptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0048	0.0421	0.2864
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0029	0.0157	0.0151
Onchocerca volvulus		0.008	0.0866	0.1531
Echinococcus multilocularis	neuropeptides capa receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	melatonin receptor type 1A	0.008	0.0866	0.0958
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	neuropeptide Y receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0172	0.0167
Echinococcus multilocularis	neuropeptides capa receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	fmrfamide receptor	0.008	0.0866	0.0909
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0315	0.4113	0.4104
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0172	0.3422
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	neuropeptide F receptor	0.008	0.0866	0.0958
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.008	0.0866	0.0852
Schistosoma mansoni	hypothetical protein	0.008	0.0866	0.0852
Brugia malayi	Tachykinin-like peptides receptor 99D	0.008	0.0866	0.0958
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0051	0.0473	1
Schistosoma mansoni	biogenic amine receptor	0.008	0.0866	0.0852
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus multilocularis	musashi	0.0054	0.0507	0.0525
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.008	0.0866	0.0958
Echinococcus multilocularis	fmrfamide receptor	0.008	0.0866	0.0909
Brugia malayi	GnHR receptor homolog	0.008	0.0866	0.0958
Loa Loa (eye worm)	G-protein coupled receptor	0.008	0.0866	0.0958
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0109	0.1265	0.8817
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus granulosus	alpha 1A adrenergic receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0358	0.4704	0.4696
Loa Loa (eye worm)	hypothetical protein	0.0347	0.4549	0.5108
Echinococcus granulosus	somatostatin receptor	0.008	0.0866	0.0909
Brugia malayi	Serotonin receptor	0.008	0.0866	0.0958
Echinococcus multilocularis	neuropeptide receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0473	0.1527
Echinococcus granulosus	neuropeptide FF receptor 2	0.008	0.0866	0.0909
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0315	0.4113	0.4104
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0109	0.1265	0.8817
Onchocerca volvulus		0.008	0.0866	0.1531
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0026	0.0122	0.0114
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.0016	0.5
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0109	0.1265	0.8817
Schistosoma mansoni	neuropeptide F-like receptor	0.008	0.0866	0.0852
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.008	0.0866	0.0958
Schistosoma mansoni	hypothetical protein	0.008	0.0866	0.0852
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0051	0.0473	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.008	0.0866	0.0909
Echinococcus multilocularis	serotonin receptor	0.008	0.0866	0.0909
Schistosoma mansoni	amine GPCR	0.008	0.0866	0.0852
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.008	0.0866	0.0852
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0172	0.0157
Echinococcus granulosus	atrial natriuretic peptide receptor 1	0.0107	0.1243	0.1312
Echinococcus granulosus	neuropeptide receptor	0.008	0.0866	0.0909
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.008	0.0866	0.0852
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.008	0.0866	0.0852
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.008	0.0866	0.0909
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	hypothetical protein	0.0107	0.1243	0.1383
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	Serotonin receptor	0.008	0.0866	0.0958
Echinococcus multilocularis	microtubule associated protein 2	0.0697	0.9372	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.008	0.0866	0.0852
Onchocerca volvulus		0.0054	0.0507	0.0739
Brugia malayi	Melatonin receptor type 1A	0.008	0.0866	0.0958
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0018	0.0016	0.033
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.008	0.0866	0.0909
Onchocerca volvulus		0.008	0.0866	0.1531
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0.0016	0.5
Echinococcus granulosus	neuropeptide Y receptor	0.008	0.0866	0.0909
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Onchocerca volvulus		0.008	0.0866	0.1531
Echinococcus granulosus	neuropeptide s receptor	0.008	0.0866	0.0909
Schistosoma mansoni	hypothetical protein	0.0299	0.3883	0.3873
Echinococcus multilocularis	orexin receptor type 2	0.008	0.0866	0.0909
Echinococcus granulosus	tachykinin peptides receptor 99D	0.008	0.0866	0.0909
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	growth hormone secretagogue receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	histamine h1 receptor	0.008	0.0866	0.0852
Echinococcus granulosus	peptide allatostatin:somatostatin	0.008	0.0866	0.0909
Brugia malayi	AKH receptor	0.008	0.0866	0.0958
Schistosoma mansoni	neuropeptide F-like receptor	0.008	0.0866	0.0852
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0051	0.0473	1
Brugia malayi	glutathione reductase	0.0048	0.0421	0.0457
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Onchocerca volvulus		0.008	0.0866	0.1531
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.008	0.0866	0.1531
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0207	0.2614	0.2928
Schistosoma mansoni	amine GPCR	0.008	0.0866	0.0852
Loa Loa (eye worm)	intermediate filament protein	0.0054	0.0507	0.0553
Echinococcus granulosus	neuropeptides capa receptor	0.008	0.0866	0.0909
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.008	0.0866	0.0852
Mycobacterium tuberculosis	Probable dehydrogenase	0.0109	0.1265	0.8817
Loa Loa (eye worm)	hypothetical protein	0.0358	0.4704	0.5283
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0051	0.0473	1
Brugia malayi	putative neuropeptide receptor NPR1	0.008	0.0866	0.0958
Echinococcus granulosus	tm gpcr rhodopsin	0.008	0.0866	0.0909
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0051	0.0473	1
Echinococcus granulosus	neuropeptide receptor A26	0.008	0.0866	0.0909
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0662	0.8891	1
Echinococcus granulosus	neuropeptide receptor	0.008	0.0866	0.0909
Echinococcus granulosus	g-protein coupled receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus multilocularis	dro:myosuppressin receptor	0.008	0.0866	0.0909
Echinococcus granulosus	thioredoxin glutathione reductase	0.0048	0.0421	0.0434
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Brugia malayi	G-protein coupled receptor	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0108	0.0104
Schistosoma mansoni	hypothetical protein	0.0168	0.2084	0.2072
Onchocerca volvulus		0.008	0.0866	0.1531
Brugia malayi	intermediate filament protein	0.0054	0.0507	0.0553
Echinococcus multilocularis	nischarin	0.0355	0.4661	0.4966
Brugia malayi	G protein-coupled receptor	0.008	0.0866	0.0958
Echinococcus granulosus	mitogen activated protein kinase	0.0051	0.0473	0.0488
Schistosoma mansoni	neuropeptide receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	mitogen activated protein kinase	0.0051	0.0473	0.0488
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0172	0.0167
Echinococcus multilocularis	neuropeptide s receptor	0.008	0.0866	0.0909
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0172	0.0157
Brugia malayi	Pre-SET motif family protein	0.0207	0.2614	0.2928
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	opsin-like receptor	0.008	0.0866	0.0852
Echinococcus multilocularis	G protein coupled receptor 139	0.008	0.0866	0.0909
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus multilocularis	neuropeptide receptor A26	0.008	0.0866	0.0909
Giardia lamblia	Kinase, CMGC MAPK	0.0051	0.0473	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0493	0.0538
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0121	0.1432	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	lamin	0.0054	0.0507	0.0492
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus granulosus	hypothetical protein	0.008	0.0866	0.0909
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0308	0.4006	0.4496
Echinococcus multilocularis	neuropeptide receptor	0.008	0.0866	0.0909
Echinococcus granulosus	tm gpcr rhodopsin	0.008	0.0866	0.0909
Brugia malayi	Adenylate and Guanylate cyclase catalytic domain containing protein	0.0358	0.4704	0.5283
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0121	0.1432	1
Plasmodium falciparum	thioredoxin reductase	0.0048	0.0421	1
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.008	0.0866	0.0958
Echinococcus multilocularis	g protein coupled receptor	0.008	0.0866	0.0909
Echinococcus granulosus	biogenic amine 5HT receptor	0.008	0.0866	0.0909
Plasmodium vivax	thioredoxin reductase, putative	0.0048	0.0421	1
Echinococcus granulosus	G protein coupled receptor 139	0.008	0.0866	0.0909
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus multilocularis	g-protein coupled receptor	0.008	0.0866	0.0909
Schistosoma mansoni	hypothetical protein	0.0051	0.0469	0.0454
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.008	0.0866	0.0852
Echinococcus granulosus	lamin	0.0054	0.0507	0.0525
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.008	0.0866	0.0909
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	g protein coupled receptor	0.008	0.0866	0.0909
Echinococcus granulosus	lamin dm0	0.0054	0.0507	0.0525
Echinococcus granulosus	g protein coupled receptor	0.008	0.0866	0.0909
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0109	0.1265	0.8817
Schistosoma mansoni	neuropeptide receptor	0.008	0.0866	0.0852
Brugia malayi	sulfakinin receptor protein	0.008	0.0866	0.0958
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.008	0.0866	0.0909
Schistosoma mansoni	opsin-like receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.003	0.0172	0.0176
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0051	0.0473	0.0515
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0029	0.0161	0.0164
Brugia malayi	G-protein coupled receptor	0.008	0.0866	0.0958
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.008	0.0866	0.0958
Echinococcus granulosus	allatostatin A receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	intermediate filament protein	0.0054	0.0507	0.0525
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.008	0.0866	0.0909
Brugia malayi	Dopamine receptor protein 2	0.008	0.0866	0.0958
Loa Loa (eye worm)	glutathione reductase	0.0048	0.0421	0.0457
Echinococcus multilocularis	g protein coupled receptor	0.008	0.0866	0.0909
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Brugia malayi	Dopamine receptor protein 1	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0473	0.1527
Echinococcus granulosus	sex peptide receptor	0.008	0.0866	0.0909
Schistosoma mansoni	amine GPCR	0.008	0.0866	0.0852
Brugia malayi	ORL1-like opioid receptor	0.008	0.0866	0.0958
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.008	0.0866	0.0909
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0051	0.0473	1
Echinococcus granulosus	g protein coupled receptor	0.008	0.0866	0.0909
Onchocerca volvulus		0.008	0.0866	0.1531
Schistosoma mansoni	intermediate filament proteins	0.0054	0.0507	0.0492
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Onchocerca volvulus	Nischarin homolog	0.0347	0.4546	0.9652
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.008	0.0866	0.0852
Brugia malayi	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.008	0.0866	0.0909
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	opsin-like receptor	0.008	0.0866	0.0852
Onchocerca volvulus		0.0235	0.3008	0.6258
Echinococcus granulosus	g protein coupled receptor	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	orexin receptor type 2	0.008	0.0866	0.0909
Brugia malayi	Dopamine receptor	0.008	0.0866	0.0958
Trichomonas vaginalis	set domain proteins, putative	0.0235	0.3008	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0026	0.0122	0.0114
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	atrial natriuretic peptide receptor 1	0.0107	0.1243	0.1312
Echinococcus granulosus	7TM GPCR rhodopsin	0.008	0.0866	0.0909
Schistosoma mansoni	lamin	0.0054	0.0507	0.0492
Echinococcus granulosus	geminin	0.0168	0.2084	0.2211
Onchocerca volvulus		0.008	0.0866	0.1531
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.008	0.0866	0.0852
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0018	0.0016	0.5
Loa Loa (eye worm)	G-protein coupled receptor	0.008	0.0866	0.0958
Echinococcus multilocularis	serotonin receptor	0.008	0.0866	0.0909
Echinococcus granulosus	neuropeptides capa receptor	0.008	0.0866	0.0909
Echinococcus multilocularis	G-protein coupled receptor, putative	0.008	0.0866	0.0909
Brugia malayi	neuropeptide F receptor	0.008	0.0866	0.0958
Echinococcus granulosus	7tm_1 domain containing protein	0.008	0.0866	0.0909
Schistosoma mansoni	biogenic amine receptor	0.008	0.0866	0.0852
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0172	0.0157
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0051	0.0473	1
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Brugia malayi	RE15519p	0.008	0.0866	0.0958
Loa Loa (eye worm)	hypothetical protein	0.0662	0.8891	1
Loa Loa (eye worm)	hypothetical protein	0.0662	0.8891	1
Brugia malayi	putative neuropeptide receptor	0.008	0.0866	0.0958
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0018	0.0016	0.5
Leishmania major	trypanothione reductase	0.0048	0.0421	0.8882
Onchocerca volvulus		0.0054	0.0507	0.0739
Onchocerca volvulus		0.008	0.0866	0.1531
Loa Loa (eye worm)	guanylyl cyclase/natriuretic peptide receptor	0.0358	0.4704	0.5283
Plasmodium vivax	glutathione reductase, putative	0.0048	0.0421	1
Onchocerca volvulus		0.008	0.0866	0.1531
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0473	0.1527
Loa Loa (eye worm)	neuropeptide F receptor	0.008	0.0866	0.0958
Echinococcus granulosus	tm gpcr rhodopsin	0.008	0.0866	0.0909
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0051	0.0473	0.0488
Echinococcus multilocularis	sex peptide receptor	0.008	0.0866	0.0909
Plasmodium vivax	SET domain protein, putative	0.003	0.0172	0.3853
Mycobacterium tuberculosis	Probable oxidoreductase	0.0121	0.1432	1
Schistosoma mansoni	neuropeptide receptor	0.008	0.0866	0.0852
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.008	0.0866	0.0909
Onchocerca volvulus		0.008	0.0866	0.1531
Schistosoma mansoni	soluble guanylyl cyclase beta-3	0.0299	0.3883	0.3873
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Onchocerca volvulus		0.008	0.0866	0.1531
Brugia malayi	follicle stimulating hormone receptor	0.0308	0.4006	0.4496
Schistosoma mansoni	hypothetical protein	0.008	0.0866	0.0852
Echinococcus multilocularis	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Schistosoma mansoni	biogenic amine receptor	0.008	0.0866	0.0852
Loa Loa (eye worm)	hypothetical protein	0.008	0.0866	0.0958
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.008	0.0866	0.0852
Schistosoma mansoni	soluble guanylate cyclase gcy	0.0315	0.4113	0.4104
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0016	0.033
Brugia malayi	larval opioid receptor	0.008	0.0866	0.0958
Loa Loa (eye worm)	TYRA-2 protein	0.008	0.0866	0.0958
Brugia malayi	Pre-SET motif family protein	0.003	0.0172	0.0176
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0054	0.0507	0.0553
Mycobacterium tuberculosis	Probable reductase	0.0109	0.1265	0.8817
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0048	0.0421	0.0434
Echinococcus multilocularis	lamin dm0	0.0054	0.0507	0.0525
Trypanosoma cruzi	trypanothione reductase, putative	0.0048	0.0421	0.8918
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0507	0.0553
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.008	0.0866	0.0958
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.008	0.0866	0.0909
Echinococcus granulosus	rhodopsin orphan GPCR	0.008	0.0866	0.0909
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0172	0.0157
Toxoplasma gondii	thioredoxin reductase	0.0048	0.0421	0.8882

Activities

Activity type	Activity value	Assay description	Source	Reference
ED50 (functional)	= 27.7 mg kg-1	Effective dose that causes 50% increase in life span of mice	ChEMBL.	3336021
ILS (functional)	= 62 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 400 mg/kg	ChEMBL.	3336021
ILS (functional)	= 140 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 60 mg/kg	ChEMBL.	3336021
ILS (functional)	> 350 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 300 mg/kg	ChEMBL.	3336021
ILS (functional)	> 550 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 100 mg/kg	ChEMBL.	3336021
ILS (functional)	> 550 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 150 mg/kg	ChEMBL.	3336021
ILS (functional)	> 550 %	Percentage increase in life span of L1210 leukemia implanted mice at a dose of 200 mg/kg	ChEMBL.	3336021
LD50 (ADMET)	= 368 mg kg-1	Lethal dose to kill 50% of the mice after single ip injection of the compound to healthy female CD2F1 mice	ChEMBL.	3336021

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

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

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External resources for this compound

ChEMBL: CHEMBL2114140

Bibliographic References

No literature references available for this target.

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Detailed information for compound 938370