TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 551.616 | Formula: C23H33N7O7S
H donors: 5 H acceptors: 8 LogP: 1.35 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: O[C@@H]1C[C@@H](O[C@@H]1COS(=O)(=O)[N-]C(=O)c1ccccc1O)n1cnc2c1c(N)ncn2.CC[NH+](CC)CC
InChi: 1S/C17H18N6O7S.C6H15N/c18-15-14-16(20-7-19-15)21-8-23(14)13-5-11(25)12(30-13)6-29-31(27,28)22-17(26)9-3-1-2-4-10(9)24;1-4-7(5-2)6-3/h1-4,7-8,11-13,25H,5-6H2,(H4,18,19,20,22,24,26);4-6H2,1-3H3/t11-,12+,13+;/m0./s1
InChiKey: PCMRIUHWJLLFPS-LUHWTZLKSA-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
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.012	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	serotonin receptor	0.0025	0.019	1
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0025	0.019	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0025	0.019	0.019
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0025	0.019	1
Echinococcus granulosus	neuropeptide receptor	0.0025	0.019	1
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0025	0.019	1
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0025	0.019	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	allatostatin A receptor	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0025	0.019	1
Echinococcus multilocularis	neuropeptides capa receptor	0.0025	0.019	1
Brugia malayi	neuropeptide F receptor	0.0025	0.019	0.0361
Schistosoma mansoni	growth hormone secretagogue receptor	0.0025	0.019	0.019
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	neuropeptides capa receptor	0.0025	0.019	1
Echinococcus granulosus	serotonin receptor	0.0025	0.019	1
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0025	0.019	0.019
Echinococcus multilocularis	neuropeptide s receptor	0.0025	0.019	1
Schistosoma mansoni	amine GPCR	0.0025	0.019	0.019
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.012	0.0229
Echinococcus multilocularis	neuropeptide receptor	0.0025	0.019	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	neuropeptide Y receptor	0.0025	0.019	1
Schistosoma mansoni	neuropeptide receptor	0.0025	0.019	0.019
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0025	0.019	1
Echinococcus multilocularis	g protein coupled receptor	0.0025	0.019	1
Schistosoma mansoni	opsin-like receptor	0.0025	0.019	0.019
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0008	0	0.5
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0008	0	0.5
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0025	0.019	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0025	0.019	0.019
Echinococcus multilocularis	somatostatin receptor	0.0025	0.019	1
Echinococcus granulosus	neuropeptide FF receptor 2	0.0025	0.019	1
Brugia malayi	Dopamine receptor	0.0025	0.019	0.0361
Schistosoma mansoni	amine GPCR	0.0025	0.019	0.019
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Schistosoma mansoni	adenoreceptor	0.0025	0.019	0.019
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.012	0.6342
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.012	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0025	0.019	0.019
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0025	0.019	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.012	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.012	0.0159
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Echinococcus granulosus	tm gpcr rhodopsin	0.0025	0.019	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Schistosoma mansoni	amine GPCR	0.0025	0.019	0.019
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0675	0.7571	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Loa Loa (eye worm)	neuropeptide F receptor	0.0025	0.019	0.0361
Brugia malayi	follicle stimulating hormone receptor	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0025	0.019	0.019
Echinococcus granulosus	fmrfamide receptor	0.0025	0.019	1
Schistosoma mansoni	biogenic amine receptor	0.0025	0.019	0.019
Echinococcus granulosus	biogenic amine 5HT receptor	0.0025	0.019	1
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0025	0.019	0.019
Echinococcus granulosus	tm gpcr rhodopsin	0.0025	0.019	1
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0025	0.019	1
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	g-protein coupled receptor	0.0025	0.019	1
Brugia malayi	neuropeptide F receptor	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.012	1
Echinococcus multilocularis	fmrfamide receptor	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Echinococcus multilocularis	neuropeptide receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Brugia malayi	Dopamine receptor protein 1	0.0471	0.5259	1
Brugia malayi	sulfakinin receptor protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0025	0.019	0.0361
Schistosoma mansoni	hypothetical protein	0.0025	0.019	0.019
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0025	0.019	1
Schistosoma mansoni	ap endonuclease	0.0019	0.012	0.012
Echinococcus granulosus	g protein coupled receptor	0.0025	0.019	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0025	0.019	0.019
Echinococcus granulosus	7tm_1 domain containing protein	0.0025	0.019	1
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0025	0.019	1
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0025	0.019	0.019
Schistosoma mansoni	neuropeptide receptor	0.0025	0.019	0.019
Echinococcus granulosus	neuropeptide Y receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	allatostatin A receptor	0.0025	0.019	1
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0025	0.019	0.0361
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0025	0.019	1
Echinococcus granulosus	neuropeptide s receptor	0.0025	0.019	1
Echinococcus multilocularis	G protein coupled receptor 139	0.0025	0.019	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.012	0.5
Echinococcus granulosus	7TM GPCR rhodopsin	0.0025	0.019	1
Brugia malayi	putative neuropeptide receptor NPR1	0.0025	0.019	0.0361
Echinococcus granulosus	biogenic amine 5HT receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	biogenic amine receptor	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0025	0.019	0.019
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.012	0.0229
Brugia malayi	RE15519p	0.0025	0.019	0.0361
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.012	1
Echinococcus multilocularis	g protein coupled receptor	0.0025	0.019	1
Echinococcus granulosus	sex peptide receptor	0.0025	0.019	1
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0025	0.019	0.0361
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	orexin receptor type 2	0.0025	0.019	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Echinococcus multilocularis	dro:myosuppressin receptor	0.0025	0.019	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0025	0.019	1
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Echinococcus granulosus	somatostatin receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	neuropeptide F-like receptor	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	neuropeptides capa receptor	0.0025	0.019	1
Schistosoma mansoni	neuropeptide receptor	0.0025	0.019	0.019
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0025	0.019	0.019
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0025	0.019	0.0361
Schistosoma mansoni	opsin-like receptor	0.0025	0.019	0.019
Brugia malayi	GnHR receptor homolog	0.0025	0.019	0.0361
Brugia malayi	Serotonin receptor	0.0025	0.019	0.0361
Echinococcus granulosus	neuropeptide receptor A26	0.0025	0.019	1
Mycobacterium leprae	POSSIBLE O-SUCCINYLBENZOIC ACID--CoA LIGASE MENE (OSB-CoA SYNTHETASE) (O-SUCCINYLBENZOATE-CoA SYNTHASE)	0.0008	0	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Brugia malayi	Dopamine receptor protein 2	0.0025	0.019	0.0361
Echinococcus granulosus	orexin receptor type 2	0.0025	0.019	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	TYRA-2 protein	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0025	0.019	0.0361
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.012	0.0159
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0025	0.019	1
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	g protein coupled receptor	0.0025	0.019	1
Schistosoma mansoni	neuropeptide receptor	0.0025	0.019	0.019
Schistosoma mansoni	biogenic amine receptor	0.0025	0.019	0.019
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0025	0.019	1
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0025	0.019	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.012	0.5
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0025	0.019	0.0361
Echinococcus granulosus	dro:myosuppressin receptor	0.0025	0.019	1
Echinococcus multilocularis	g protein coupled receptor	0.0025	0.019	1
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0025	0.019	0.019
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0025	0.019	1
Mycobacterium ulcerans	bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase	0.0675	0.7571	1
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	neuropeptides capa receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	amine GPCR	0.0025	0.019	0.019
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0025	0.019	0.019
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0025	0.019	0.019
Echinococcus granulosus	g-protein coupled receptor	0.0025	0.019	1
Echinococcus multilocularis	fmrfamide receptor	0.0025	0.019	1
Loa Loa (eye worm)	G-protein coupled receptor	0.0025	0.019	0.0361
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Brugia malayi	larval opioid receptor	0.0025	0.019	0.0361
Brugia malayi	hypothetical protein	0.0025	0.019	0.0361
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.012	0.5
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.012	1
Brugia malayi	G-protein coupled receptor	0.0025	0.019	0.0361
Mycobacterium leprae	Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase)	0.0008	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0025	0.019	1
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0025	0.019	0.0361
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0025	0.019	0.019
Schistosoma mansoni	hypothetical protein	0.0025	0.019	0.019
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0025	0.019	0.0361
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.012	1
Loa Loa (eye worm)	neuropeptide F receptor	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0025	0.019	0.019
Mycobacterium leprae	POSSIBLE FATTY-ACID-CoA LIGASE FADD10 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0008	0	0.5
Echinococcus multilocularis	neuropeptide receptor A26	0.0025	0.019	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0025	0.019	1
Echinococcus granulosus	G protein coupled receptor 139	0.0025	0.019	1
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	hypothetical protein	0.0025	0.019	1
Brugia malayi	Melatonin receptor type 1A	0.0025	0.019	0.0361
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0025	0.019	1
Toxoplasma gondii	exonuclease III APE	0.0019	0.012	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	myosin xvIII	0.0025	0.019	0.019
Loa Loa (eye worm)	G-protein coupled receptor	0.0025	0.019	0.0361
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.012	1
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0025	0.019	1
Loa Loa (eye worm)	melatonin receptor type 1A	0.0025	0.019	0.0361
Echinococcus granulosus	g protein coupled receptor	0.0025	0.019	1
Echinococcus granulosus	neuropeptide receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	neuropeptide F-like receptor	0.0025	0.019	0.019
Schistosoma mansoni	opsin-like receptor	0.0025	0.019	0.019
Schistosoma mansoni	neuropeptide f receptor 76f	0.0025	0.019	0.019
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus granulosus	rhodopsin orphan GPCR	0.0025	0.019	1
Onchocerca volvulus		0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Schistosoma mansoni	histamine h1 receptor	0.0025	0.019	0.019
Brugia malayi	G protein-coupled receptor F59B2.13	0.0025	0.019	0.0361
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.012	1
Schistosoma mansoni	ap endonuclease	0.0019	0.012	0.012
Brugia malayi	G protein-coupled receptor	0.0025	0.019	0.0361
Brugia malayi	ORL1-like opioid receptor	0.0025	0.019	0.0361
Brugia malayi	putative neuropeptide receptor	0.0025	0.019	0.0361
Schistosoma mansoni	hypothetical protein	0.0025	0.019	0.019
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.012	0.6342
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Echinococcus multilocularis	neuropeptide Y receptor	0.0025	0.019	1
Echinococcus multilocularis	serotonin receptor	0.0025	0.019	1
Schistosoma mansoni	hypothetical protein	0.0025	0.019	0.019
Echinococcus multilocularis	sex peptide receptor	0.0025	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0025	0.019	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0471	0.5259	1
Echinococcus granulosus	neuropeptide Y receptor	0.0025	0.019	1
Brugia malayi	AKH receptor	0.0025	0.019	0.0361
Brugia malayi	G-protein coupled receptor	0.0025	0.019	0.0361
Onchocerca volvulus		0.0025	0.019	1
Brugia malayi	Serotonin receptor	0.0025	0.019	0.0361

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki app (binding)	= 0.0035 uM	Inhibition of Mycobacterium tuberculosis MbtA by [32P]PPi-ATP exchange assay	ChEMBL.	17181146
MIC99 (functional)	0	Inhibitory activity against Yersinia pseudotuberculosis ATCC 6902	ChEMBL.	17181146
MIC99 (functional)	= 25 uM	Antitubercular activity against Mycobacterium tuberculosis H37Rv	ChEMBL.	17181146

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: 466371

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 411556