TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 567.698 | Formula: C33H33N3O4S
H donors: 1 H acceptors: 2 LogP: 5.48 Rotable bonds: 7
Rule of 5 violations (Lipinski): 2
SMILES: O=C(Nc1ccc(c2c1c1ccccc1s2)c1cccc2c1oc(cc2=O)N1CCOCC1)CCN1CCCCC1
InChi: 1S/C33H33N3O4S/c37-27-21-30(36-17-19-39-20-18-36)40-32-22(8-6-9-24(27)32)23-11-12-26(31-25-7-2-3-10-28(25)41-33(23)31)34-29(38)13-16-35-14-4-1-5-15-35/h2-3,6-12,21H,1,4-5,13-20H2,(H,34,38)
InChiKey: UWAATOBVVDUPGJ-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
Homo sapiens	protein kinase, DNA-activated, catalytic polypeptide	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	Get druggable targets OG5_132688	All targets in OG5_132688
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	Get druggable targets OG5_132688	All targets in OG5_132688

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
Onchocerca volvulus		0.0068	0.1745	0.1868
Onchocerca volvulus		0.0094	0.2603	0.311
Onchocerca volvulus		0.0068	0.1745	0.1868
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0298	0.0363
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0068	0.1745	0.3934
Brugia malayi	RE15519p	0.0068	0.1745	0.2723
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0313	1	1
Plasmodium vivax	glutathione reductase, putative	0.0037	0.0706	1
Echinococcus granulosus	g protein coupled receptor	0.0068	0.1745	0.1584
Onchocerca volvulus		0.0068	0.1745	0.1868
Brugia malayi	glutathione reductase	0.0037	0.0706	0.1102
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0068	0.1745	0.3934
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0068	0.1745	0.1584
Loa Loa (eye worm)	neuropeptide F receptor	0.0068	0.1745	0.2499
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0068	0.1745	0.2499
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0068	0.1745	0.1584
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0085	0.2307	0.8342
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus multilocularis	fmrfamide receptor	0.0068	0.1745	0.1584
Brugia malayi	Dopamine receptor	0.0068	0.1745	0.2723
Onchocerca volvulus		0.0068	0.1745	0.1868
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0068	0.1745	0.3934
Schistosoma mansoni	neuropeptide f receptor 76f	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	Serotonin receptor	0.0068	0.1745	0.2723
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0085	0.2307	0.8342
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Brugia malayi	hypothetical protein	0.0025	0.0298	0.0466
Brugia malayi	Pre-SET motif family protein	0.003	0.0453	0.0708
Mycobacterium tuberculosis	Probable dehydrogenase	0.0085	0.2307	0.8342
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0068	0.1745	0.1584
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0664	0.0659
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Schistosoma mansoni	biogenic amine receptor	0.0068	0.1745	0.3934
Brugia malayi	G-protein coupled receptor	0.0068	0.1745	0.2723
Schistosoma mansoni	hypothetical protein	0.0068	0.1745	0.3934
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus granulosus	tm gpcr rhodopsin	0.0068	0.1745	0.1584
Loa Loa (eye worm)	neuropeptide F receptor	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Mycobacterium tuberculosis	Probable reductase	0.0085	0.2307	0.8342
Schistosoma mansoni	hypothetical protein	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus granulosus	neuropeptide receptor A26	0.0068	0.1745	0.1584
Schistosoma mansoni	amine GPCR	0.0068	0.1745	0.3934
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0984	0.2008
Schistosoma mansoni	neuropeptide F-like receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	melatonin receptor type 1A	0.0068	0.1745	0.2499
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0029	0.0417	0.023
Onchocerca volvulus		0.0068	0.1745	0.1868
Brugia malayi	Pre-SET motif family protein	0.0207	0.6407	1
Echinococcus multilocularis	dro:myosuppressin receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0068	0.1745	0.3934
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0068	0.1745	0.1584
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0068	0.1745	0.1584
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0036	0.0664	0.0659
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Trypanosoma cruzi	trypanothione reductase, putative	0.0037	0.0706	0.1743
Echinococcus multilocularis	neuropeptide s receptor	0.0068	0.1745	0.1584
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0068	0.1745	0.2723
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0068	0.1745	0.1584
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0068	0.1745	0.2499
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0068	0.1745	0.3934
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0298	0.0363
Onchocerca volvulus		0.0235	0.7367	1
Echinococcus granulosus	serotonin receptor	0.0068	0.1745	0.1584
Schistosoma mansoni	neuropeptide receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0162	0.4897	0.4798
Onchocerca volvulus		0.0068	0.1745	0.1868
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0068	0.1745	0.3934
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0068	0.1745	0.1584
Trypanosoma brucei	glucosidase, putative	0.0036	0.0664	0.9183
Echinococcus granulosus	orexin receptor type 2	0.0068	0.1745	0.1584
Echinococcus granulosus	allatostatin A receptor	0.0068	0.1745	0.1584
Entamoeba histolytica	hypothetical protein	0.0036	0.0658	0.9876
Brugia malayi	neuropeptide F receptor	0.0068	0.1745	0.2723
Onchocerca volvulus		0.0068	0.1745	0.1868
Loa Loa (eye worm)	hypothetical protein	0.003	0.0453	0.0422
Schistosoma mansoni	adenoreceptor	0.0068	0.1745	0.3934
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.0723	0.0542
Brugia malayi	Dopamine receptor protein 2	0.0068	0.1745	0.2723
Schistosoma mansoni	histamine h1 receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	neuropeptide Y receptor	0.0068	0.1745	0.1584
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0036	0.0664	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0453	0.0664
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0068	0.1745	0.1584
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0068	0.1745	0.1584
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	sulfakinin receptor protein	0.0068	0.1745	0.2723
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus granulosus	neuropeptides capa receptor	0.0068	0.1745	0.1584
Onchocerca volvulus		0.0068	0.1745	0.1868
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	amine GPCR	0.0068	0.1745	0.3934
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0658	0.0476
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0085	0.2307	0.8342
Schistosoma mansoni	biogenic amine receptor	0.0068	0.1745	0.3934
Brugia malayi	G-protein coupled receptor	0.0068	0.1745	0.2723
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0036	0.0664	0.0761
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0658	0.1182
Echinococcus granulosus	biogenic amine 5HT receptor	0.0068	0.1745	0.1584
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0664	0.0659
Echinococcus granulosus	lysosomal alpha glucosidase	0.0162	0.4897	0.4798
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0453	0.0664
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0068	0.1745	0.2723
Loa Loa (eye worm)	cytochrome P450 family protein	0.0022	0.0212	0.0034
Brugia malayi	putative neuropeptide receptor NPR1	0.0068	0.1745	0.2723
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0068	0.1745	0.1584
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0068	0.1745	0.3934
Echinococcus granulosus	neuropeptide Y receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0984	0.0808
Echinococcus granulosus	neutral alpha glucosidase AB	0.0036	0.0664	0.0482
Echinococcus granulosus	neuropeptide FF receptor 2	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	AKH receptor	0.0068	0.1745	0.2723
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	ORL1-like opioid receptor	0.0068	0.1745	0.2723
Giardia lamblia	GTOR	0.0022	0.0191	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Schistosoma mansoni	biogenic amine receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus multilocularis	g protein coupled receptor	0.0068	0.1745	0.1584
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0068	0.1745	0.3934
Plasmodium vivax	thioredoxin reductase, putative	0.0037	0.0706	1
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0453	0.5096
Brugia malayi	Serotonin receptor	0.0068	0.1745	0.2723
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	Melatonin receptor type 1A	0.0068	0.1745	0.2723
Schistosoma mansoni	opsin-like receptor	0.0068	0.1745	0.3934
Schistosoma mansoni	alpha-glucosidase	0.0139	0.414	1
Echinococcus granulosus	neuropeptide receptor	0.0068	0.1745	0.1584
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0068	0.1745	0.3934
Brugia malayi	putative neuropeptide receptor	0.0068	0.1745	0.2723
Schistosoma mansoni	myosin xvIII	0.0068	0.1745	0.3934
Echinococcus granulosus	g protein coupled receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0036	0.0664	0.1036
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus granulosus	neuropeptide receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Echinococcus granulosus	hypothetical protein	0.0068	0.1745	0.1584
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0036	0.0664	0.0482
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0068	0.1745	0.3934
Echinococcus granulosus	somatostatin receptor	0.0068	0.1745	0.1584
Schistosoma mansoni	amine GPCR	0.0068	0.1745	0.3934
Echinococcus granulosus	7tm_1 domain containing protein	0.0068	0.1745	0.1584
Schistosoma mansoni	amine GPCR	0.0068	0.1745	0.3934
Echinococcus multilocularis	neuropeptides capa receptor	0.0068	0.1745	0.1584
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0068	0.1745	0.2723
Onchocerca volvulus		0.0068	0.1745	0.1868
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	glutathione reductase	0.0037	0.0706	0.0828
Schistosoma mansoni	opsin-like receptor	0.0068	0.1745	0.3934
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0984	0.2008
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Leishmania major	alpha glucosidase II subunit, putative	0.0036	0.0664	0.1528
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0207	0.6407	1
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	g protein coupled receptor	0.0068	0.1745	0.1584
Plasmodium vivax	SET domain protein, putative	0.003	0.0453	0.3806
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0094	0.2625	1
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Echinococcus granulosus	tm gpcr rhodopsin	0.0068	0.1745	0.1584
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0036	0.0664	0.9183
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus multilocularis	sex peptide receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	g-protein coupled receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	7TM GPCR rhodopsin	0.0068	0.1745	0.1584
Onchocerca volvulus		0.0068	0.1745	0.1868
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Schistosoma mansoni	hypothetical protein	0.0068	0.1745	0.3934
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Schistosoma mansoni	amine GPCR	0.0068	0.1745	0.3934
Loa Loa (eye worm)	thioredoxin reductase	0.0037	0.0706	0.0828
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0453	0.0267
Echinococcus multilocularis	neuropeptides capa receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	G protein coupled receptor 139	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0068	0.1745	0.1868
Echinococcus multilocularis	G protein coupled receptor 139	0.0068	0.1745	0.1584
Brugia malayi	neuropeptide F receptor	0.0068	0.1745	0.2723
Loa Loa (eye worm)	TYRA-2 protein	0.0068	0.1745	0.2499
Brugia malayi	larval opioid receptor	0.0068	0.1745	0.2723
Echinococcus multilocularis	orexin receptor type 2	0.0068	0.1745	0.1584
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Echinococcus multilocularis	serotonin receptor	0.0068	0.1745	0.1584
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0036	0.0664	0.0659
Loa Loa (eye worm)	G-protein coupled receptor	0.0068	0.1745	0.2499
Echinococcus multilocularis	g protein coupled receptor	0.0068	0.1745	0.1584
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0094	0.2625	1
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Brugia malayi	Cytochrome P450 family protein	0.0022	0.0212	0.0331
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Schistosoma mansoni	neuropeptide receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	allatostatin A receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0162	0.4897	0.7572
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0298	0.2083
Brugia malayi	follicle stimulating hormone receptor	0.0068	0.1745	0.2723
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0068	0.1745	0.2499
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0085	0.2307	0.8342
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0068	0.1745	0.1584
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0453	0.0664
Echinococcus multilocularis	neuropeptide Y receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0658	0.0476
Echinococcus granulosus	dro:myosuppressin receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.0723	0.0542
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Onchocerca volvulus		0.0068	0.1745	0.1868
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	neuropeptide s receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	neuropeptide receptor	0.0068	0.1745	0.1584
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0664	0.1601
Brugia malayi	G protein-coupled receptor	0.0068	0.1745	0.2723
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Leishmania major	trypanothione reductase	0.0037	0.0706	0.1664
Echinococcus granulosus	neuropeptides capa receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0068	0.1745	0.1584
Plasmodium falciparum	glutathione reductase	0.0037	0.0706	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0984	0.0808
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0984	0.2008
Trichomonas vaginalis	sucrase-isomaltase, putative	0.0036	0.0664	0.0659
Trichomonas vaginalis	set domain proteins, putative	0.0235	0.7367	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0984	0.1536
Schistosoma mansoni	opsin-like receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0068	0.1745	0.1584
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus granulosus	fmrfamide receptor	0.0068	0.1745	0.1584
Schistosoma mansoni	neuropeptide receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0068	0.1745	0.2723
Entamoeba histolytica	hypothetical protein	0.0036	0.0658	0.9876
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0068	0.1745	0.3934
Trypanosoma brucei	trypanothione reductase	0.0037	0.0706	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0664	0.1601
Toxoplasma gondii	thioredoxin reductase	0.0037	0.0706	1
Schistosoma mansoni	alpha-glucosidase	0.0139	0.414	1
Echinococcus granulosus	sex peptide receptor	0.0068	0.1745	0.1584
Echinococcus granulosus	g protein coupled receptor	0.0068	0.1745	0.1584
Brugia malayi	Thioredoxin reductase	0.0037	0.0706	0.1102
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0068	0.1745	0.1584
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0068	0.1745	0.1584
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0036	0.0664	1
Entamoeba histolytica	hypothetical protein	0.0036	0.0658	0.9876
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0664	0.0659
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0068	0.1745	0.2723
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0984	0.0808
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0191	0.0298
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Plasmodium falciparum	thioredoxin reductase	0.0037	0.0706	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0068	0.1745	0.3934
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0453	0.0664
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0162	0.4897	0.4798
Echinococcus multilocularis	somatostatin receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0984	0.0808
Schistosoma mansoni	hypothetical protein	0.0068	0.1745	0.3934
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0068	0.1745	0.3934
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Echinococcus granulosus	tm gpcr rhodopsin	0.0068	0.1745	0.1584
Brugia malayi	hypothetical protein	0.0036	0.0658	0.1027
Brugia malayi	hypothetical protein	0.0068	0.1745	0.2723
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0984	0.1276
Leishmania major	hypothetical protein, conserved	0.0114	0.3286	1
Schistosoma mansoni	growth hormone secretagogue receptor	0.0068	0.1745	0.3934
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0068	0.1745	0.1584
Onchocerca volvulus		0.0068	0.1745	0.1868
Leishmania major	hypothetical protein, conserved	0.0025	0.0298	0.0347
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0068	0.1745	0.1868
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Schistosoma mansoni	alpha glucosidase	0.0036	0.0664	0.1197
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0162	0.4897	0.7644
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0068	0.1745	0.2723
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0298	0.2083
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0664	0.0659
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0068	0.1745	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0453	0.0267
Echinococcus granulosus	rhodopsin orphan GPCR	0.0068	0.1745	0.1584
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0094	0.2625	1
Brugia malayi	GnHR receptor homolog	0.0068	0.1745	0.2723
Schistosoma mansoni	neuropeptide receptor	0.0068	0.1745	0.3934
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0022	0.0191	0.0298
Brugia malayi	G protein-coupled receptor F59B2.13	0.0068	0.1745	0.2723
Loa Loa (eye worm)	G-protein coupled receptor	0.0068	0.1745	0.2499
Schistosoma mansoni	hypothetical protein	0.0036	0.0658	0.1182
Echinococcus multilocularis	serotonin receptor	0.0068	0.1745	0.1584
Trypanosoma cruzi	hypothetical protein, conserved	0.011	0.3144	1
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	fmrfamide receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0664	0.0659
Entamoeba histolytica	hypothetical protein	0.0036	0.0658	0.9876
Echinococcus multilocularis	neuropeptide receptor	0.0068	0.1745	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1745	0.2499
Mycobacterium tuberculosis	Probable oxidoreductase	0.0094	0.2625	1
Echinococcus granulosus	g-protein coupled receptor	0.0068	0.1745	0.1584
Brugia malayi	Dopamine receptor protein 1	0.0068	0.1745	0.2723
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0036	0.0664	0.0659
Echinococcus granulosus	neuropeptide Y receptor	0.0068	0.1745	0.1584
Echinococcus multilocularis	neuropeptide receptor A26	0.0068	0.1745	0.1584
Schistosoma mansoni	neuropeptide F-like receptor	0.0068	0.1745	0.3934
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0453	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0298	0.0173

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 37 nM	Inhibition of human DNA-PK using GST-tagged p53N66 as substrate after 1 hr by ELISA-based chemiluminiscence assay	ChEMBL.	23855836

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: CHEMBL2420317

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1771982