TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 521.587 | Formula: C23H31N5O7S
H donors: 5 H acceptors: 8 LogP: 2.39 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: CS(=O)(=O)O.CCN(c1nc(NCCNC(=O)c2cc(O)c(c(c2)O)OC)c2c(n1)cccc2)CC
InChi: 1S/C22H27N5O4.CH4O3S/c1-4-27(5-2)22-25-16-9-7-6-8-15(16)20(26-22)23-10-11-24-21(30)14-12-17(28)19(31-3)18(29)13-14;1-5(2,3)4/h6-9,12-13,28-29H,4-5,10-11H2,1-3H3,(H,24,30)(H,23,25,26);1H3,(H,2,3,4)
InChiKey: RNKOQRKODGOKCT-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

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)	G-protein-linked acetylcholine receptor protein 2	0.0144	0.0213	0.0195
Loa Loa (eye worm)	tubulin beta-2A chain	0.009	0.0053	0.0035
Trichomonas vaginalis	conserved hypothetical protein	0.0165	0.0274	0.0468
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	tubulin beta 4A class IVa	0.009	0.0053	0.0035
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Loa Loa (eye worm)	subtilase	0.0165	0.0274	0.0257
Giardia lamblia	High cysteine membrane protein Group 2	0.1004	0.2779	1
Echinococcus granulosus	neuroendocrine convertase 2	0.2492	0.7221	0.7216
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0165	0.0274	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Toxoplasma gondii	subtilisin SUB4	0.0165	0.0274	0.7201
Echinococcus multilocularis	orexin receptor type 2	0.0144	0.0213	0.0251
Onchocerca volvulus		0.0144	0.0213	0.3269
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0144	0.0213	0.0251
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	tubulin alpha chain, putative	0.009	0.0053	0.0064
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Echinococcus granulosus	Furin 1	0.0982	0.2714	0.2701
Trichomonas vaginalis	conserved hypothetical protein	0.0165	0.0274	0.0468
Echinococcus granulosus	allatostatin A receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	biogenic amine 5HT receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	amine GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0165	0.0274	0.0257
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0106	0.0088
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	G protein coupled receptor 139	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus multilocularis	beta tubulin	0.009	0.0053	0.0045
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0165	0.0274	0.0257
Echinococcus multilocularis	sex peptide receptor	0.0144	0.0213	0.0251
Onchocerca volvulus		0.0108	0.0106	0.1626
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Toxoplasma gondii	subtilisin SUB1	0.0165	0.0274	0.7201
Loa Loa (eye worm)	tubulin beta-4 chain	0.009	0.0053	0.0035
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	g protein coupled receptor	0.0144	0.0213	0.0251
Echinococcus multilocularis	somatostatin receptor	0.0144	0.0213	0.0251
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0144	0.0213	0.0195
Brugia malayi	putative neuropeptide receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Onchocerca volvulus		0.0291	0.0651	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus multilocularis	Furin 1	0.0982	0.2714	0.3474
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0144	0.0213	0.0251
Onchocerca volvulus		0.0144	0.0213	0.3269
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0053	0.0045
Brugia malayi	beta-tubulin, identical	0.009	0.0053	0.0035
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0165	0.0274	0.5
Echinococcus multilocularis	fmrfamide receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0144	0.0213	0.0195
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0144	0.0213	0.0195
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Schistosoma mansoni	neuropeptide receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	neuropeptide F receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.0745	0.2005	0.3631
Brugia malayi	proprotein convertase 2	0.2492	0.7221	0.7216
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0144	0.0213	0.0251
Brugia malayi	neuropeptide F receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	BEN-1 protein	0.009	0.0053	0.0035
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	neuropeptide receptor	0.0912	0.2506	0.3206
Leishmania major	subtilisin-like serine peptidase	0.0165	0.0274	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0144	0.0213	0.0195
Brugia malayi	neuropeptide F receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Echinococcus granulosus	g-protein coupled receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	furin	0.3424	1	1
Loa Loa (eye worm)	melatonin receptor type 1A	0.0144	0.0213	0.0195
Echinococcus multilocularis	serotonin receptor	0.0144	0.0213	0.0251
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Schistosoma mansoni	hypothetical protein	0.0108	0.0106	0.0088
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0165	0.0274	0.5
Plasmodium vivax	subtilisin-like protease 1	0.0165	0.0274	1
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	neuropeptide receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	protein will die slowly	0.0144	0.0212	0.0195
Echinococcus granulosus	serotonin receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Echinococcus multilocularis	baculoviral IAP repeat containing protein	0.0108	0.0106	0.0114
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Toxoplasma gondii	subtilisin SUB8	0.0165	0.0274	0.7201
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Loa Loa (eye worm)	neuropeptide F receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.0982	0.2714	0.2701
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0165	0.0274	0.5
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0144	0.0213	0.0195
Toxoplasma gondii	subtilisin SUB9	0.0165	0.0274	0.7201
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Toxoplasma gondii	subtilisin SUB6	0.0165	0.0274	0.7201
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0144	0.0213	0.0251
Trichomonas vaginalis	conserved hypothetical protein	0.0165	0.0274	0.0468
Toxoplasma gondii	subtilisin SUB5	0.0165	0.0274	0.7201
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1913	0.5493	1
Onchocerca volvulus		0.0096	0.0069	0.1063
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.0818	0.2222	0.4027
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Brugia malayi	Serotonin receptor	0.0144	0.0213	0.0195
Toxoplasma gondii	kringle domain-containing protein	0.0096	0.0069	0.0538
Brugia malayi	Melatonin receptor type 1A	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0257	0.055	0.8455
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0144	0.0213	0.0251
Echinococcus granulosus	neuropeptide receptor A26	0.0144	0.0213	0.0195
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0165	0.0274	0.0257
Echinococcus multilocularis	neuropeptide s receptor	0.0144	0.0213	0.0251
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0053	0.0035
Schistosoma mansoni	opsin-like receptor	0.0144	0.0213	0.0195
Brugia malayi	Trypsin family protein	0.0291	0.0651	0.0634
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0053	0.0045
Trichomonas vaginalis	tubulin beta chain, putative	0.009	0.0053	0.0064
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0053	0.0035
Echinococcus granulosus	baculoviral IAP repeat containing protein	0.0108	0.0106	0.0088
Echinococcus granulosus	sex peptide receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	amine GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0053	0.0035
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus multilocularis	allatostatin A receptor	0.0144	0.0213	0.0251
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.0108	0.0106	0.0088
Trichomonas vaginalis	conserved hypothetical protein	0.0165	0.0274	0.0468
Schistosoma mansoni	neuropeptide receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	dro:myosuppressin receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Brugia malayi	ORL1-like opioid receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	neuropeptide F-like receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	somatostatin receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	biogenic amine receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0532	0.1371	0.1356
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0651	0.0634
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	amine GPCR	0.0144	0.0213	0.0195
Echinococcus granulosus	neuropeptides capa receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Echinococcus granulosus	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	G-protein coupled receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.3424	1	1
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.0818	0.2222	0.4027
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	fmrfamide receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0144	0.0213	0.0195
Brugia malayi	Furin-like cysteine rich region family protein	0.0381	0.0921	0.0904
Echinococcus granulosus	neuropeptide FF receptor 2	0.0364	0.087	0.0854
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0144	0.0213	0.3269
Toxoplasma gondii	subtilisin SUB11	0.0165	0.0274	0.7201
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Toxoplasma gondii	subtilisin SUB10	0.0165	0.0274	0.7201
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Loa Loa (eye worm)	WD40 repeat protein	0.0144	0.0212	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0165	0.0274	0.0257
Brugia malayi	follicle stimulating hormone receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Schistosoma mansoni	furin-1 (S08 family)	0.1675	0.4781	0.4772
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0165	0.0274	1
Entamoeba histolytica	tubulin family protein	0.009	0.0053	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Plasmodium falciparum	subtilisin-like protease 1	0.0165	0.0274	1
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0165	0.0274	0.5
Brugia malayi	Dopamine receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0144	0.0213	0.0195
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0291	0.0651	0.0634
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0144	0.0213	0.0195
Plasmodium falciparum	subtilisin-like protease 2	0.0165	0.0274	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	tyrosine kinase	0.0381	0.0921	0.0904
Loa Loa (eye worm)	endoprotease bli-4	0.3424	1	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Onchocerca volvulus		0.0144	0.0213	0.3269
Brugia malayi	Kringle domain containing protein	0.0096	0.0069	0.0051
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	G-protein coupled receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Brugia malayi	Protein kinase domain containing protein	0.0096	0.0069	0.0051
Leishmania major	hypothetical protein, conserved	0.0096	0.0069	0.0748
Echinococcus granulosus	tm gpcr rhodopsin	0.0144	0.0213	0.0195
Echinococcus multilocularis		0.2679	0.7777	1
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0144	0.0213	0.0251
Echinococcus multilocularis	neuropeptides capa receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	7TM GPCR rhodopsin	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Schistosoma mansoni	opsin-like receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.1913	0.5493	0.7056
Loa Loa (eye worm)	hypothetical protein	0.0096	0.0069	0.0051
Schistosoma mansoni	biogenic amine receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0144	0.0213	0.0251
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Brugia malayi	Will die slowly protein	0.0144	0.0212	0.0195
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0053	0.0035
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Echinococcus multilocularis	G protein coupled receptor 139	0.0912	0.2506	0.3206
Echinococcus granulosus	epidermal growth factor receptor	0.0381	0.0921	0.0904
Schistosoma mansoni	biogenic amine receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0364	0.087	0.0854
Echinococcus granulosus	g protein coupled receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	Tubulin beta 2C chain	0.009	0.0053	0.0035
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Brugia malayi	Tubulin beta-1 chain	0.009	0.0053	0.0035
Toxoplasma gondii	subtilisin SUB12	0.0193	0.036	1
Brugia malayi	Serotonin receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0144	0.0213	0.0251
Schistosoma mansoni	neuropeptide F-like receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Echinococcus multilocularis	g-protein coupled receptor	0.0144	0.0213	0.0251
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0053	0.0045
Trypanosoma cruzi	hypothetical protein, conserved	0.0096	0.0069	0.0748
Echinococcus multilocularis	neuropeptides capa receptor	0.0144	0.0213	0.0251
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus granulosus	dro:myosuppressin receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	fmrfamide receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	tubulin subunit beta	0.009	0.0053	0.0035
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0165	0.0274	0.5
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.1583	0.4507	0.4497
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0165	0.0274	0.033
Loa Loa (eye worm)	proprotein convertase 2	0.0982	0.2714	0.2701
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Schistosoma mansoni	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	hypothetical protein	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0237	0.0491	0.0864
Loa Loa (eye worm)	tubulin beta-1 chain	0.009	0.0053	0.0035
Trypanosoma cruzi	subtilisin peptidase	0.0165	0.0274	1
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	inhibitor of apoptosis protein	0.0108	0.0106	0.0088
Echinococcus granulosus	beta tubulin	0.009	0.0053	0.0035
Loa Loa (eye worm)	TYRA-2 protein	0.0144	0.0213	0.0195
Schistosoma mansoni	histamine h1 receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0651	0.0634
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Schistosoma mansoni	neuropeptide receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0237	0.0491	0.0474
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0165	0.0274	0.0257
Onchocerca volvulus		0.0165	0.0274	0.4207
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0053	0.0045
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Onchocerca volvulus		0.0144	0.0213	0.3269
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0165	0.0274	1
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Brugia malayi	Dopamine receptor protein 1	0.0144	0.0213	0.0195
Echinococcus granulosus	neuropeptide s receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	g protein coupled receptor	0.0144	0.0213	0.0195
Brugia malayi	G protein-coupled receptor F59B2.13	0.0144	0.0213	0.0195
Brugia malayi	G protein-coupled receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.009	0.0053	0.0045
Echinococcus granulosus	neuropeptide Y receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Brugia malayi	RE15519p	0.0144	0.0213	0.0195
Schistosoma mansoni	inhibitor of apoptosis protein	0.0108	0.0106	0.0088
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0165	0.0274	0.5
Echinococcus multilocularis	Tubulin beta 2C chain	0.009	0.0053	0.0045
Echinococcus granulosus	orexin receptor type 2	0.0144	0.0213	0.0195
Plasmodium falciparum	subtilisin-like protease 3	0.0165	0.0274	1
Brugia malayi	larval opioid receptor	0.0144	0.0213	0.0195
Echinococcus multilocularis	neuroendocrine convertase 2	0.2492	0.7221	0.9283
Echinococcus multilocularis	g protein coupled receptor	0.0144	0.0213	0.0251
Brugia malayi	sulfakinin receptor protein	0.0144	0.0213	0.0195
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0144	0.0213	0.0195
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Brugia malayi	celfurPC protein	0.2679	0.7777	0.7773
Loa Loa (eye worm)	beta-tubulin	0.009	0.0053	0.0035
Loa Loa (eye worm)	tubulin beta chain	0.009	0.0053	0.0035
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.3424	1	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0144	0.0213	0.0251
Trichomonas vaginalis	tubulin, putative	0.009	0.0053	0.0064
Giardia lamblia	Furin precursor putative serine protease	0.0818	0.2222	0.7959
Schistosoma mansoni	hypothetical protein	0.0096	0.0069	0.0051
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0364	0.087	0.1098
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0144	0.0213	0.0195
Toxoplasma gondii	subtilisin SUB2	0.0165	0.0274	0.7201
Brugia malayi	putative neuropeptide receptor NPR1	0.0144	0.0213	0.0195
Entamoeba histolytica	tubulin family protein	0.009	0.0053	0.5
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0212	0.3262
Loa Loa (eye worm)	BEN-1 protein	0.009	0.0053	0.0035
Echinococcus granulosus	biogenic amine 5HT receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	7tm_1 domain containing protein	0.0144	0.0213	0.0195
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Brugia malayi	G-protein coupled receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	g protein coupled receptor	0.0144	0.0213	0.0195
Echinococcus granulosus	tissue type plasminogen activator	0.0096	0.0069	0.0051
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0364	0.087	0.0854
Echinococcus multilocularis	serotonin receptor	0.0144	0.0213	0.0251
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0291	0.0651	0.0634
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Onchocerca volvulus	Deterin homolog	0.0108	0.0106	0.1626
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0165	0.0274	0.033
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Plasmodium vivax	cysteine repeat modular protein 1, putative	0.0096	0.0069	0.0748
Brugia malayi	AKH receptor	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus multilocularis	beta tubulin	0.009	0.0053	0.0045
Schistosoma mansoni	amine GPCR	0.0144	0.0213	0.0195
Echinococcus granulosus	tm gpcr rhodopsin	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	neuropeptide receptor	0.0912	0.2506	0.2492
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0106	0.0088
Trichomonas vaginalis	WD repeat domain, putative	0.0144	0.0212	0.0355
Schistosoma mansoni	tubulin subunit beta	0.009	0.0053	0.0035
Echinococcus multilocularis	tissue type plasminogen activator	0.0096	0.0069	0.0066
Echinococcus granulosus	neuropeptide receptor	0.0912	0.2506	0.2492
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	neuropeptide receptor	0.0144	0.0213	0.0195
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0144	0.0213	0.3269
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus multilocularis	neuropeptide Y receptor	0.0144	0.0213	0.0251
Brugia malayi	neuroendocrine convertase 1 precursor	0.2952	0.8592	0.859
Trichomonas vaginalis	tubulin epsilon chain, putative	0.009	0.0053	0.0064
Trichomonas vaginalis	conserved hypothetical protein	0.0165	0.0274	0.0468
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Brugia malayi	Dopamine receptor protein 2	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Schistosoma mansoni	inhibitor of apoptosis (iap) domain family member	0.0108	0.0106	0.0088
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	myosin xvIII	0.0144	0.0213	0.0195
Brugia malayi	Subtilase family protein	0.0165	0.0274	0.0257
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Plasmodium falciparum	cysteine repeat modular protein 1	0.0096	0.0069	0.0748
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0165	0.0274	1
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.1913	0.5493	0.5485
Schistosoma mansoni	opsin-like receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0144	0.0213	0.0195
Echinococcus multilocularis	neuropeptide receptor A26	0.0144	0.0213	0.0251
Echinococcus multilocularis	neuropeptide Y receptor	0.0144	0.0213	0.0251
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus granulosus	rhodopsin orphan GPCR	0.0144	0.0213	0.0195
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0144	0.0213	0.0195
Plasmodium vivax	subtilisin-like serine protease, putative	0.0165	0.0274	1
Brugia malayi	G-protein coupled receptor	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	TK/ROR protein kinase	0.0096	0.0069	0.0051
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0144	0.0213	0.0195
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0165	0.0274	1
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Onchocerca volvulus		0.0144	0.0213	0.3269
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Trichomonas vaginalis	tubulin epsilon chain, putative	0.009	0.0053	0.0064
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus granulosus	beta tubulin	0.009	0.0053	0.0035
Onchocerca volvulus		0.0144	0.0213	0.3269
Echinococcus multilocularis	tubulin beta 1 chain	0.009	0.0053	0.0045
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Onchocerca volvulus		0.0144	0.0213	0.3269
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Echinococcus multilocularis	tubulin subunit beta	0.009	0.0053	0.0045
Echinococcus multilocularis	inhibitor of apoptosis protein	0.0108	0.0106	0.0114
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0144	0.0213	0.0195
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0165	0.0274	0.0257
Schistosoma mansoni	neuropeptide f receptor 76f	0.0144	0.0213	0.0195
Schistosoma mansoni	hypothetical protein	0.0144	0.0213	0.0195
Toxoplasma gondii	subtilisin SUB7	0.0165	0.0274	0.7201
Echinococcus granulosus	neuropeptides capa receptor	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1913	0.5493	1
Trichomonas vaginalis	conserved hypothetical protein	0.0745	0.2005	0.3631
Brugia malayi	GnHR receptor homolog	0.0144	0.0213	0.0195
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0381	0.0921	0.0904
Trypanosoma brucei	subtilisin peptidase	0.0165	0.0274	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0982	0.2714	0.4924
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0165	0.0274	0.0257
Echinococcus granulosus	membrane bound transcription factor site 1	0.0165	0.0274	0.0257
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Schistosoma mansoni	hypothetical protein	0.0745	0.2005	0.1991
Mycobacterium leprae	Possible secreted protease	0.0165	0.0274	0.5
Echinococcus multilocularis	protein will die slowly	0.0144	0.0212	0.0251
Schistosoma mansoni	growth hormone secretagogue receptor	0.0144	0.0213	0.0195
Plasmodium vivax	subtilisin-like protease 2, putative	0.0165	0.0274	1
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.0108	0.0106	0.0088
Echinococcus granulosus	neuropeptide Y receptor	0.0144	0.0213	0.0195
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0144	0.0213	0.0195
Echinococcus multilocularis	g protein coupled receptor	0.0144	0.0213	0.0251
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0144	0.0213	0.0195
Trichomonas vaginalis	hypothetical protein	0.0745	0.2005	0.3631
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0165	0.0274	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Schistosoma mansoni	amine GPCR	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Schistosoma mansoni	adenoreceptor	0.0144	0.0213	0.0195
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0144	0.0213	0.0195
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0165	0.0274	0.0468
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0144	0.0213	0.0251
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Onchocerca volvulus		0.0144	0.0213	0.3269
Trichomonas vaginalis	tubulin gamma chain, putative	0.009	0.0053	0.0064
Brugia malayi	hypothetical protein	0.0144	0.0213	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0213	0.0195
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0165	0.0274	0.5
Echinococcus granulosus	tubulin beta 1 chain	0.009	0.0053	0.0035
Echinococcus multilocularis	epidermal growth factor receptor	0.0381	0.0921	0.1163
Schistosoma mansoni	hypothetical protein	0.0144	0.0212	0.0195

Activities

Activity type	Activity value	Assay description	Source	Reference
E1/2 (binding)	= 320 mV	Oxidation potential of the compound was determined as carbon paste disc electrode against a Ag/AgCl reference electrode	ChEMBL.	No reference
EC50 (functional)	= 9.5 uM	Inhibition of C5a-induced luminol dependent chemiluminescenceof human neutrophils	ChEMBL.	No reference
EC50 (functional)	= 9.5 uM	Inhibition of C5a-induced luminol dependent chemiluminescenceof human neutrophils	ChEMBL.	No reference
IogP	= 3.29	cLog P of the compound was calculated	ChEMBL.	No reference
MIC (functional)	> 100 uM	In vitro inhibition of iron-dependent peroxidation of rabbit brain vesicular membrane lipids	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23

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: CHEMBL14171

Bibliographic References

No literature references available for this target.

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Detailed information for compound 13521