TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 499.536 | Formula: C24H25N3O7S
H donors: 3 H acceptors: 5 LogP: 2.06 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(OC)c(cc1NC(=O)CCC(=O)O)S(=O)(=O)N(c1ccc(cc1)N)c1ccccc1
InChi: 1S/C24H25N3O7S/c1-33-20-15-21(34-2)22(14-19(20)26-23(28)12-13-24(29)30)35(31,32)27(17-6-4-3-5-7-17)18-10-8-16(25)9-11-18/h3-11,14-15H,12-13,25H2,1-2H3,(H,26,28)(H,29,30)
InChiKey: LOWPPNMRMWEKTJ-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

Species	Target name	Source	Bibliographic reference
Escherichia coli	fused N-acetyl glucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyl transferase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium tuberculosis	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	Get druggable targets OG5_131193	All targets in OG5_131193
Mycobacterium ulcerans	bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase	Get druggable targets OG5_131193	All targets in OG5_131193
Mycobacterium leprae	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	Get druggable targets OG5_131193	All targets in OG5_131193
Wolbachia endosymbiont of Brugia malayi	N-acetylglucosamine-1-phosphate uridyltransferase	Get druggable targets OG5_131193	All targets in OG5_131193

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	RNA binding protein	0.0063	0.0212	0.0577
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0111	0.0494	0.0484
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0109	0.0099
Echinococcus multilocularis	sex peptide receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	neuropeptide receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0111	0.0494	0.0478
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0111	0.0494	0.0478
Brugia malayi	GnHR receptor homolog	0.0111	0.0494	0.1344
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	neuropeptide receptor A26	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	hypothetical protein	0.0338	0.1831	0.1818
Schistosoma mansoni	hypothetical protein	0.0111	0.0494	0.0478
Echinococcus multilocularis	neuropeptide receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	microtubule associated protein 2	0.0659	0.3715	0.3708
Mycobacterium tuberculosis	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	0.0684	0.3865	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0111	0.0494	0.0484
Mycobacterium ulcerans	molybdopterin-guanine dinucleotide biosynthesis protein A	0.0125	0.0581	0.102
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0125	0.0581	0.102
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Brugia malayi	putative neuropeptide receptor	0.0111	0.0494	0.1344
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	neuropeptides capa receptor	0.0111	0.0494	0.0484
Schistosoma mansoni	hypothetical protein	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Echinococcus granulosus	7TM GPCR rhodopsin	0.0111	0.0494	0.0484
Echinococcus multilocularis	neuropeptide s receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	neuropeptides capa receptor	0.0111	0.0494	0.0478
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0111	0.0494	0.0478
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0651	0.3672	0.5
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	adenoreceptor	0.0111	0.0494	0.0478
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.0212	0.0195
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.0212	0.0195
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0111	0.0494	0.3953
Echinococcus multilocularis	somatostatin receptor	0.0111	0.0494	0.0478
Mycobacterium ulcerans	bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase	0.0684	0.3865	1
Brugia malayi	G protein-coupled receptor	0.0111	0.0494	0.1344
Schistosoma mansoni	growth hormone secretagogue receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	microtubule-associated protein tau	0.0659	0.3715	0.3704
Echinococcus granulosus	tm gpcr rhodopsin	0.0111	0.0494	0.0484
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0111	0.0494	0.0478
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	neuropeptide F receptor	0.0111	0.0494	0.0494
Echinococcus multilocularis	allatostatin A receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Echinococcus multilocularis	geminin	0.0338	0.1831	0.1818
Brugia malayi	Dopamine receptor protein 2	0.0111	0.0494	0.1344
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0075	0.0285	0.0275
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Mycobacterium leprae	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	0.0684	0.3865	0.5
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0111	0.0494	0.0478
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.003	0.0017	0.0017
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	Muscleblind-like protein	0.0143	0.0681	0.1855
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0111	0.0494	0.0494
Schistosoma mansoni	hypothetical protein	0.0111	0.0494	0.0478
Wolbachia endosymbiont of Brugia malayi	N-acetylglucosamine-1-phosphate uridyltransferase	0.0684	0.3865	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0109	0.0093
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	Pre-SET motif family protein	0.003	0.0017	0.0046
Brugia malayi	RE15519p	0.0111	0.0494	0.1344
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0651	0.3672	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0111	0.0494	0.1344
Echinococcus granulosus	orexin receptor type 2	0.0111	0.0494	0.0484
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0111	0.0494	0.0478
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0111	0.0494	0.1344
Brugia malayi	RNA recognition motif domain containing protein	0.0063	0.0212	0.0577
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	neuropeptides capa receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0111	0.0494	0.0484
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0111	0.0494	0.0494
Onchocerca volvulus	Huntingtin homolog	0.0117	0.053	0.4259
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	g-protein coupled receptor	0.0111	0.0494	0.0484
Brugia malayi	neuropeptide F receptor	0.0111	0.0494	0.1344
Echinococcus multilocularis	neuropeptide receptor A26	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Treponema pallidum	licC protein (licC)	0.0125	0.0581	0.5
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	g protein coupled receptor	0.0111	0.0494	0.0484
Schistosoma mansoni	biogenic amine receptor	0.0111	0.0494	0.0478
Mycobacterium ulcerans	hypothetical protein	0.0125	0.0581	0.102
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0063	0.0212	0.0212
Brugia malayi	ORL1-like opioid receptor	0.0111	0.0494	0.1344
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Echinococcus granulosus	tar DNA binding protein	0.0063	0.0212	0.0202
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	opsin-like receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	muscleblind protein	0.0143	0.0681	0.0671
Schistosoma mansoni	neuropeptide receptor	0.0111	0.0494	0.0478
Onchocerca volvulus		0.0111	0.0494	0.3953
Onchocerca volvulus		0.0111	0.0494	0.3953
Brugia malayi	G-protein coupled receptor	0.0111	0.0494	0.1344
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus granulosus	serotonin receptor	0.0111	0.0494	0.0484
Brugia malayi	larval opioid receptor	0.0111	0.0494	0.1344
Echinococcus granulosus	G protein coupled receptor 139	0.0111	0.0494	0.0484
Loa Loa (eye worm)	melatonin receptor type 1A	0.0111	0.0494	0.0494
Echinococcus multilocularis	orexin receptor type 2	0.0111	0.0494	0.0478
Loa Loa (eye worm)	G-protein coupled receptor	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0681	0.0681
Leishmania major	C-8 sterol isomerase-like protein	0.0651	0.3672	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0111	0.0494	0.1344
Echinococcus granulosus	7tm_1 domain containing protein	0.0111	0.0494	0.0484
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	biogenic amine receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	neuropeptide receptor	0.0111	0.0494	0.0484
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0111	0.0494	0.0478
Onchocerca volvulus	Huntingtin homolog	0.0117	0.053	0.4259
Echinococcus granulosus	allatostatin A receptor	0.0111	0.0494	0.0484
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Brugia malayi	AKH receptor	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	amine GPCR	0.0111	0.0494	0.0478
Echinococcus multilocularis	fmrfamide receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0111	0.0494	0.0484
Echinococcus granulosus	neuropeptides capa receptor	0.0111	0.0494	0.0484
Echinococcus granulosus	fmrfamide receptor	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	g protein coupled receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	fmrfamide receptor	0.0111	0.0494	0.0478
Onchocerca volvulus		0.0111	0.0494	0.3953
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	neuropeptide F-like receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Schistosoma mansoni	histamine h1 receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.1728	1	1
Brugia malayi	sulfakinin receptor protein	0.0111	0.0494	0.1344
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	biogenic amine (5HT) receptor	0.1728	1	1
Brugia malayi	Melatonin receptor type 1A	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	G protein-coupled receptor F59B2.13	0.0111	0.0494	0.1344
Toxoplasma gondii	aldehyde dehydrogenase	0.0062	0.0207	0.3381
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0681	0.0681
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus granulosus	geminin	0.0338	0.1831	0.1823
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Loa Loa (eye worm)	neuropeptide F receptor	0.0111	0.0494	0.0494
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	hypothetical protein	0.0053	0.0153	0.0137
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0111	0.0494	0.0484
Brugia malayi	Dopamine receptor protein 1	0.0111	0.0494	0.1344
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0111	0.0494	0.0478
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0651	0.3672	0.5
Onchocerca volvulus		0.0111	0.0494	0.3953
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0111	0.0494	0.0478
Schistosoma mansoni	amine GPCR	0.0111	0.0494	0.0478
Echinococcus multilocularis	g protein coupled receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	opsin-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0109	0.0093
Echinococcus granulosus	neuropeptide FF receptor 2	0.0111	0.0494	0.0484
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	biogenic amine receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0111	0.0494	0.0478
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0111	0.0494	0.0478
Echinococcus multilocularis	neuropeptide Y receptor	0.0111	0.0494	0.0478
Brugia malayi	follicle stimulating hormone receptor	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	G-protein coupled receptor	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0117	0.053	0.053
Echinococcus multilocularis	g-protein coupled receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	microtubule associated protein 2	0.0659	0.3715	0.3704
Echinococcus granulosus	dro:myosuppressin receptor	0.0111	0.0494	0.0484
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0111	0.0494	0.3953
Echinococcus granulosus	g protein coupled receptor	0.0111	0.0494	0.0484
Onchocerca volvulus		0.0235	0.1223	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Echinococcus multilocularis	dro:myosuppressin receptor	0.0111	0.0494	0.0478
Brugia malayi	G-protein coupled receptor	0.0111	0.0494	0.1344
Loa Loa (eye worm)	hypothetical protein	0.0333	0.18	0.18
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0109	0.0298
Echinococcus multilocularis	tar DNA binding protein	0.0063	0.0212	0.0195
Echinococcus multilocularis	serotonin receptor	0.1728	1	1
Echinococcus multilocularis	neuropeptide receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0111	0.0494	0.0478
Echinococcus granulosus	neuropeptide receptor	0.0111	0.0494	0.0484
Toxoplasma gondii	eukaryotic initiation factor-2B, gamma subunit, putative	0.0125	0.0581	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0109	0.0093
Echinococcus granulosus	somatostatin receptor	0.0111	0.0494	0.0484
Loa Loa (eye worm)	RNA binding protein	0.0063	0.0212	0.0212
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0111	0.0494	0.0478
Echinococcus granulosus	hypothetical protein	0.0111	0.0494	0.0484
Echinococcus granulosus	rhodopsin orphan GPCR	0.0111	0.0494	0.0484
Brugia malayi	Serotonin receptor	0.0111	0.0494	0.1344
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0109	0.0093
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0117	0.053	0.053
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0111	0.0494	0.0478
Brugia malayi	TAR-binding protein	0.0063	0.0212	0.0577
Schistosoma mansoni	amine GPCR	0.0111	0.0494	0.0478
Schistosoma mansoni	neuropeptide F-like receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	neuropeptide s receptor	0.0111	0.0494	0.0484
Schistosoma mansoni	opsin-like receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.0212	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	G protein coupled receptor 139	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	Serotonin receptor	0.0111	0.0494	0.1344
Onchocerca volvulus		0.0111	0.0494	0.3953
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.0212	0.0195
Onchocerca volvulus		0.0111	0.0494	0.3953
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0206	0.1055	0.1055
Brugia malayi	putative neuropeptide receptor NPR1	0.0111	0.0494	0.1344
Schistosoma mansoni	aldehyde dehydrogenase	0.0062	0.0207	0.0191
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0111	0.0494	0.0484
Echinococcus granulosus	neuropeptide Y receptor	0.0111	0.0494	0.0484
Echinococcus multilocularis	muscleblind protein 1	0.0143	0.0681	0.0665
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0111	0.0494	0.0484
Echinococcus multilocularis	muscleblind protein	0.0143	0.0681	0.0665
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Plasmodium vivax	SET domain protein, putative	0.003	0.0017	0.5
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	neuropeptide F receptor	0.0111	0.0494	0.1344
Loa Loa (eye worm)	TAR-binding protein	0.0063	0.0212	0.0212
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	TYRA-2 protein	0.0111	0.0494	0.0494
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0111	0.0494	0.1344
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0062	0.0207	0.0191
Onchocerca volvulus		0.0111	0.0494	0.3953
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0111	0.0494	0.0494
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0111	0.0494	0.0478
Schistosoma mansoni	amine GPCR	0.0449	0.2482	0.2469
Schistosoma mansoni	hypothetical protein	0.0111	0.0494	0.0478
Schistosoma mansoni	neuropeptide receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	tm gpcr rhodopsin	0.0111	0.0494	0.0484
Echinococcus multilocularis	g protein coupled receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0109	0.0093
Loa Loa (eye worm)	hypothetical protein	0.1728	1	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	serotonin receptor	0.1728	1	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0111	0.0494	0.0484
Schistosoma mansoni	hypothetical protein	0.0338	0.1831	0.1818
Echinococcus multilocularis	neuropeptide Y receptor	0.0111	0.0494	0.0478
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0109	0.0109
Brugia malayi	hypothetical protein	0.0117	0.053	0.1444
Echinococcus granulosus	sex peptide receptor	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Brugia malayi	Pre-SET motif family protein	0.0206	0.1055	0.2872
Mycobacterium ulcerans	hypothetical protein	0.0125	0.0581	0.102
Schistosoma mansoni	amine GPCR	0.0111	0.0494	0.0478
Onchocerca volvulus		0.0111	0.0494	0.3953
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.0212	0.0195
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0111	0.0494	0.1344
Onchocerca volvulus		0.0111	0.0494	0.3953
Loa Loa (eye worm)	hypothetical protein	0.0651	0.3672	0.3672
Trichomonas vaginalis	set domain proteins, putative	0.0235	0.1222	0.5
Brugia malayi	hypothetical protein	0.0111	0.0494	0.1344
Brugia malayi	Dopamine receptor	0.0111	0.0494	0.1344
Schistosoma mansoni	neuropeptide receptor	0.0111	0.0494	0.0478
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0111	0.0494	0.0478
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0111	0.0494	0.0478
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0075	0.0285	0.0269
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0111	0.0494	0.0484
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0111	0.0494	0.0494
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0125	0.0581	0.102
Echinococcus granulosus	neuropeptide Y receptor	0.0111	0.0494	0.0484
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0111	0.0494	0.0478
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0062	0.0207	0.0197
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	myosin xvIII	0.0111	0.0494	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Schistosoma mansoni	neuropeptide f receptor 76f	0.0111	0.0494	0.0478
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0017	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	g protein coupled receptor	0.0111	0.0494	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0109	0.0099
Onchocerca volvulus		0.0111	0.0494	0.3953
Schistosoma mansoni	aldehyde dehydrogenase	0.0062	0.0207	0.0191
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0494	0.0494
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0111	0.0494	0.0478

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.699	Inhibition of Escherichia coli GlmU acetyltransferase activity assessed as coenzyme A production using acetyl CoA substrate	ChEMBL.	25544688
IC50 (binding)	= 0.02 uM	Inhibition of Escherichia coli GlmU acetyltransferase activity assessed as coenzyme A production using acetyl CoA substrate	ChEMBL.	25544688

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: CHEMBL2207601

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1687263