TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 459.512 | Formula: C27H26FN3O3
H donors: 1 H acceptors: 3 LogP: 4.65 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CC1CCC(CC1)NC(=O)c1cc2cc(cnc2n(c1=O)Cc1ccc(cc1)F)c1ccco1
InChi: 1S/C27H26FN3O3/c1-17-4-10-22(11-5-17)30-26(32)23-14-19-13-20(24-3-2-12-34-24)15-29-25(19)31(27(23)33)16-18-6-8-21(28)9-7-18/h2-3,6-9,12-15,17,22H,4-5,10-11,16H2,1H3,(H,30,32)
InChiKey: GMRANXCAUYRGNO-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	cannabinoid receptor 1 (brain)	Starlite/ChEMBL	References
Homo sapiens	cannabinoid receptor 2 (macrophage)	Starlite/ChEMBL	References

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
Brugia malayi	putative neuropeptide receptor NPR1	0.0015	0.0027	0.0055
Mycobacterium ulcerans	sensor kinase from two component regulatory system	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Entamoeba histolytica	DNA topoisomerase II, putative	0.0046	0.0212	0.5
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0016	0.0032	0.0065
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	allatostatin A receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0819	0.4926	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	g protein coupled receptor	0.0015	0.0027	0.0027
Brugia malayi	Serotonin receptor	0.048	0.286	0.5806
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0046	0.0212	0.043
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0015	0.0027	0.0027
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0015	0.0027	0.0027
Echinococcus granulosus	fmrfamide receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	survival motor neuron protein 1	0.0262	0.1532	0.1532
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Toxoplasma gondii	pyruvate dehydrogenase kinase, putative	0.0286	0.1679	0.8409
Brugia malayi	integrin-linked kinase	0.0088	0.0472	0.0958
Schistosoma mansoni	pyruvate dehydrogenase	0.0774	0.4649	0.9436
Brugia malayi	Dopamine receptor protein 1	0.0015	0.0027	0.0055
Treponema pallidum	chemotaxis histidine kinase (cheA)	0.0046	0.0212	0.5
Echinococcus granulosus	7tm_1 domain containing protein	0.0015	0.0027	0.0027
Brugia malayi	Probable DNA topoisomerase II	0.0046	0.0212	0.043
Echinococcus granulosus	lamin	0.003	0.0116	0.0116
Onchocerca volvulus		0.0053	0.026	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	amine GPCR	0.0015	0.0027	0.0055
Mycobacterium tuberculosis	Two component sensor histidine kinase PrrB	0.0046	0.0212	0.5
Schistosoma mansoni	opsin-like receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0113	0.0229
Schistosoma mansoni	biogenic amine receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	lamin dm0	0.003	0.0116	0.0116
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0819	0.4926	0.4926
Entamoeba histolytica	heat shock protein 90, putative	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.003	0.0116	0.0236
Brugia malayi	sulfakinin receptor protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Brugia malayi	Serotonin receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	amine GPCR	0.0015	0.0027	0.0055
Brugia malayi	cytoplasmic intermediate filament protein	0.0016	0.0032	0.0065
Schistosoma mansoni	lamin	0.003	0.0116	0.0236
Echinococcus granulosus	g protein coupled receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	G protein coupled receptor 139	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Trypanosoma cruzi	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0286	0.1679	0.3113
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0014	0.0022	0.0022
Brugia malayi	RNA binding protein	0.007	0.0362	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.0046	0.0212	0.5
Schistosoma mansoni	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	neuropeptide Y receptor	0.0015	0.0027	0.0027
Plasmodium falciparum	DNA topoisomerase VI, b subunit, putative	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0212	0.043
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0046	0.0212	0.7933
Schistosoma mansoni	tar DNA-binding protein	0.007	0.0362	0.0735
Echinococcus multilocularis	heat shock protein	0.0046	0.0212	0.0212
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0015	0.0027	0.0027
Echinococcus multilocularis	neuropeptides capa receptor	0.0015	0.0027	0.0027
Mycobacterium ulcerans	two component sensory transduction histidine kinase MtrB	0.0046	0.0212	0.5
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0015	0.0027	0.0055
Brugia malayi	putative neuropeptide receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	musashi	0.003	0.0116	0.0116
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	opsin-like receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	G-protein coupled receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	tar DNA binding protein	0.007	0.0362	0.0362
Echinococcus granulosus	neuropeptide receptor	0.0015	0.0027	0.0027
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0046	0.0212	0.5
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	g protein coupled receptor	0.0015	0.0027	0.0027
Brugia malayi	RE15519p	0.0015	0.0027	0.0055
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.007	0.0362	0.0735
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0015	0.0027	0.0055
Plasmodium vivax	hypothetical protein, conserved	0.0046	0.0212	0.5
Wolbachia endosymbiont of Brugia malayi	membrane associated signal transduction histidine kinase	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	neuropeptide receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	pyruvate dehydrogenase	0.0774	0.4649	0.9436
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	DNA topoisomerase II	0.0046	0.0212	0.043
Schistosoma mansoni	tar DNA-binding protein	0.007	0.0362	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	tar DNA binding protein	0.007	0.0362	0.0362
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0015	0.0027	0.0027
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Mycobacterium ulcerans	two component sensor kinase MprB	0.0046	0.0212	0.5
Brugia malayi	Dopamine receptor protein 2	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	g protein coupled receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0015	0.0027	0.0027
Schistosoma mansoni	heat shock protein	0.0046	0.0212	0.043
Loa Loa (eye worm)	neuropeptide F receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	amine GPCR	0.0015	0.0027	0.0055
Schistosoma mansoni	pyruvate dehydrogenase	0.0819	0.4926	1
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0015	0.0027	0.0027
Echinococcus granulosus	Pyruvate dehydrogenase lipoamide kinase	0.0819	0.4926	0.4926
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0015	0.0027	0.0055
Chlamydia trachomatis	DNA gyrase subunit B	0.0046	0.0212	0.5
Mycobacterium leprae	Probable two component sensor kinase MprB	0.0046	0.0212	0.5
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0046	0.0212	0.7933
Schistosoma mansoni	neuropeptide receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.0046	0.0212	0.5
Trichomonas vaginalis	heat shock protein, putative	0.0046	0.0212	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	protein kinase	0.0088	0.0472	0.0958
Brugia malayi	G protein-coupled receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	neuropeptide receptor	0.0015	0.0027	0.0027
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	neuropeptide receptor A26	0.0015	0.0027	0.0027
Schistosoma mansoni	biogenic amine receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0015	0.0027	0.0027
Plasmodium vivax	DNA topoisomerase II, putative	0.0046	0.0212	0.5
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0015	0.0027	0.0027
Brugia malayi	GnHR receptor homolog	0.0015	0.0027	0.0055
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	neuropeptide F-like receptor	0.0015	0.0027	0.0055
Trichomonas vaginalis	heat shock protein, putative	0.0046	0.0212	1
Echinococcus granulosus	sex peptide receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0015	0.0027	0.0055
Mycobacterium leprae	Probable two-component sensor kinase	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	survival motor neuron protein	0.0053	0.026	0.0528
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	survival motor neuron protein 1	0.0262	0.1532	0.1532
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.0046	0.0212	0.5
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0015	0.0027	0.0027
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.1652	1	1
Mycobacterium tuberculosis	Two component sensor kinase [second part]	0.0046	0.0212	0.5
Plasmodium vivax	heat shock protein 86, putative	0.0046	0.0212	0.5
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0046	0.0212	1
Echinococcus multilocularis	lamin dm0	0.003	0.0116	0.0116
Brugia malayi	intermediate filament protein	0.003	0.0116	0.0236
Mycobacterium tuberculosis	Two component sensor histidine kinase TrcS	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Wolbachia endosymbiont of Brugia malayi	DNA gyrase, topoisomerase II, B subunit, GyrB	0.0046	0.0212	0.5
Echinococcus granulosus	hypothetical protein	0.0015	0.0027	0.0027
Mycobacterium tuberculosis	Probable two component sensor kinase	0.0046	0.0212	0.5
Brugia malayi	G protein-coupled receptor F59B2.13	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0015	0.0027	0.0055
Treponema pallidum	DNA gyrase, subunit B (gyrB)	0.0046	0.0212	0.5
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0015	0.0027	0.0027
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0014	0.0022	0.0022
Giardia lamblia	Pms1-like protein	0.0046	0.0212	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0015	0.0027	0.0055
Brugia malayi	heat shock protein 90	0.0046	0.0212	0.043
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.003	0.0116	0.0236
Echinococcus granulosus	g protein coupled receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	neuropeptide f receptor 76f	0.0015	0.0027	0.0055
Loa Loa (eye worm)	TAR-binding protein	0.007	0.0362	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0212	0.043
Loa Loa (eye worm)	neuropeptide F receptor	0.0015	0.0027	0.0055
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0053	0.026	0.0528
Schistosoma mansoni	tar DNA-binding protein	0.007	0.0362	0.0735
Echinococcus granulosus	neuropeptide s receptor	0.0015	0.0027	0.0027
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0015	0.0027	0.0055
Echinococcus granulosus	7TM GPCR rhodopsin	0.0015	0.0027	0.0027
Echinococcus granulosus	g protein coupled receptor	0.0015	0.0027	0.0027
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0332	0.1957	1
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0015	0.0027	0.0027
Schistosoma mansoni	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0046	0.0212	0.043
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0015	0.0027	0.0027
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0015	0.0027	0.0027
Trichomonas vaginalis	mismatch repair protein Mlh1C (mutL homolog)	0.0046	0.0212	1
Schistosoma mansoni	hypothetical protein	0.0053	0.026	0.0528
Echinococcus granulosus	neuropeptides capa receptor	0.0015	0.0027	0.0027
Mycobacterium tuberculosis	Conserved protein	0.0046	0.0212	0.5
Echinococcus granulosus	heat shock protein 90	0.0046	0.0212	0.0212
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	heat shock protein 90	0.0046	0.0212	0.0212
Plasmodium vivax	DNA gyrase subunit B, putative	0.0046	0.0212	0.5
Mycobacterium tuberculosis	Probable sensor protein KdpD	0.0046	0.0212	0.5
Brugia malayi	TAR-binding protein	0.007	0.0362	0.0735
Schistosoma mansoni	amine GPCR	0.0015	0.0027	0.0055
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0015	0.0027	0.0027
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0037	0.0161	0.0161
Echinococcus granulosus	somatostatin receptor	0.0015	0.0027	0.0027
Echinococcus granulosus	neuropeptide Y receptor	0.0015	0.0027	0.0027
Plasmodium vivax	endoplasmin, putative	0.0046	0.0212	0.5
Echinococcus granulosus	tm gpcr rhodopsin	0.0015	0.0027	0.0027
Schistosoma mansoni	histamine h1 receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Trichomonas vaginalis	sensory transduction histidine kinase, putative	0.0046	0.0212	1
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0046	0.0212	1
Schistosoma mansoni	neuropeptide receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	intermediate filament protein	0.003	0.0116	0.0116
Echinococcus granulosus	heat shock protein	0.0046	0.0212	0.0212
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	heat shock protein 90	0.0046	0.0212	0.043
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Trichomonas vaginalis	receptor histidine kinase, putative	0.0046	0.0212	1
Onchocerca volvulus		0.003	0.0116	0.3834
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0819	0.4926	0.4926
Echinococcus granulosus	neuropeptide receptor A26	0.0015	0.0027	0.0027
Brugia malayi	kinase, mitochondrial precursor	0.0819	0.4926	1
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.0182	0.037
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0037	0.0161	0.0161
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0015	0.0027	0.0027
Brugia malayi	ORL1-like opioid receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	neuropeptide FF receptor 2	0.0015	0.0027	0.0027
Schistosoma mansoni	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	g-protein coupled receptor	0.0015	0.0027	0.0027
Onchocerca volvulus		0.003	0.0116	0.3834
Echinococcus granulosus	g-protein coupled receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0015	0.0027	0.0055
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.0182	0.037
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0022	0.0045
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0015	0.0027	0.0055
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Echinococcus granulosus	dro:myosuppressin receptor	0.0015	0.0027	0.0027
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0046	0.0212	1
Schistosoma mansoni	neuropeptide receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	TKL/MLK/ILK protein kinase	0.0088	0.0472	0.0958
Schistosoma mansoni	amine GPCR	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	0.0046	0.0212	0.5
Echinococcus granulosus	biogenic amine 5HT receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	protein kinase	0.0088	0.0472	0.0958
Schistosoma mansoni	intermediate filament proteins	0.003	0.0116	0.0236
Mycobacterium tuberculosis	Possible two component system response sensor kinase membrane associated PhoR	0.0046	0.0212	0.5
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0015	0.0027	0.0027
Echinococcus granulosus	allatostatin A receptor	0.0015	0.0027	0.0027
Brugia malayi	neuropeptide F receptor	0.0015	0.0027	0.0055
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0015	0.0027	0.0027
Mycobacterium tuberculosis	Two component sensory transduction histidine kinase MtrB	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0262	0.1532	0.3109
Plasmodium falciparum	DNA gyrase subunit B	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	neuropeptide receptor	0.0015	0.0027	0.0055
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	0.0046	0.0212	0.5
Schistosoma mansoni	endoplasmin	0.0046	0.0212	0.043
Mycobacterium ulcerans	two component sensor histidine kinase SenX3	0.0046	0.0212	0.5
Mycobacterium tuberculosis	Two component sensor kinase MprB	0.0046	0.0212	0.5
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0015	0.0027	0.0055
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0015	0.0027	0.0055
Trichomonas vaginalis	two component sensor and regulator histidine kinase bacteria, putative	0.0046	0.0212	1
Mycobacterium tuberculosis	Possible two component sensor kinase TcrY	0.0046	0.0212	0.5
Echinococcus multilocularis	somatostatin receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	tar DNA-binding protein	0.007	0.0362	0.0735
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0037	0.0161	0.0328
Brugia malayi	larval opioid receptor	0.0015	0.0027	0.0055
Trichomonas vaginalis	endoplasmin, putative	0.0046	0.0212	1
Mycobacterium ulcerans	putative regultory protein	0.0046	0.0212	0.5
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0015	0.0027	0.0055
Entamoeba histolytica	heat shock protein 90, putative	0.0046	0.0212	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Echinococcus granulosus	orexin receptor type 2	0.0015	0.0027	0.0027
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Echinococcus multilocularis	serotonin receptor	0.0015	0.0027	0.0027
Brugia malayi	AKH receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	TOPoisomerase family member	0.0046	0.0212	0.043
Echinococcus granulosus	tm gpcr rhodopsin	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0037	0.0161	0.0328
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Mycobacterium leprae	PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3	0.0046	0.0212	0.5
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0046	0.0212	0.0212
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0015	0.0027	0.0055
Echinococcus granulosus	neuropeptide receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus granulosus	serotonin receptor	0.0015	0.0027	0.0027
Mycobacterium ulcerans	two component sensor histidine kinase TrcS	0.0046	0.0212	0.5
Echinococcus multilocularis	orexin receptor type 2	0.0015	0.0027	0.0027
Echinococcus granulosus	integrin linked protein kinase	0.0088	0.0472	0.0472
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	myosin xvIII	0.0015	0.0027	0.0055
Schistosoma mansoni	heat shock protein	0.0046	0.0212	0.043
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0046	0.0212	0.0212
Echinococcus granulosus	biogenic amine 5HT receptor	0.0015	0.0027	0.0027
Trypanosoma brucei	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0286	0.1679	0.3113
Trypanosoma brucei	developmentally regulated phosphoprotein	0.0819	0.4926	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0015	0.0027	0.0027
Brugia malayi	Melatonin receptor type 1A	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0019	0.0038
Echinococcus granulosus	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Echinococcus multilocularis	fmrfamide receptor	0.0015	0.0027	0.0027
Chlamydia trachomatis	DNA gyrase subunit B	0.0046	0.0212	0.5
Brugia malayi	RNA recognition motif domain containing protein	0.007	0.0362	0.0735
Brugia malayi	Endoplasmin precursor	0.0046	0.0212	0.043
Brugia malayi	hypothetical protein	0.0015	0.0027	0.0055
Brugia malayi	follicle stimulating hormone receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	G-protein coupled receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0015	0.0027	0.0055
Plasmodium falciparum	endoplasmin, putative	0.0046	0.0212	0.5
Schistosoma mansoni	neuropeptide F-like receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	G protein coupled receptor 139	0.0015	0.0027	0.0027
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0131	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Brugia malayi	Dopamine receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	adenoreceptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	endoplasmin	0.0046	0.0212	0.043
Trypanosoma cruzi	developmentally regulated phosphoprotein, putative	0.0819	0.4926	1
Leishmania major	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0286	0.1679	0.3113
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0046	0.0212	0.5
Mycobacterium ulcerans	DNA gyrase subunit B	0.0046	0.0212	0.5
Mycobacterium ulcerans	two component regulator - sensor kinase	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	neuropeptide Y receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	melatonin receptor type 1A	0.0015	0.0027	0.0055
Echinococcus multilocularis	dro:myosuppressin receptor	0.0015	0.0027	0.0027
Leishmania major	developmentally regulated phosphoprotein-like protein	0.0819	0.4926	1
Echinococcus granulosus	neuropeptides capa receptor	0.0015	0.0027	0.0027
Schistosoma mansoni	hypothetical protein	0.0015	0.0027	0.0055
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0015	0.0027	0.0027
Echinococcus multilocularis	neuropeptide s receptor	0.0015	0.0027	0.0027
Trichomonas vaginalis	receptor histidine kinase, putative	0.0046	0.0212	1
Wolbachia endosymbiont of Brugia malayi	signal transduction histidine kinase and receiver	0.0046	0.0212	0.5
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0015	0.0027	0.0055
Plasmodium falciparum	heat shock protein 90	0.0046	0.0212	0.5
Brugia malayi	G-protein coupled receptor	0.0015	0.0027	0.0055
Echinococcus granulosus	neuropeptide Y receptor	0.0015	0.0027	0.0027
Brugia malayi	Intermediate filament tail domain containing protein	0.003	0.0116	0.0236
Brugia malayi	hypothetical protein	0.0262	0.1532	0.3109
Mycobacterium ulcerans	two component system response phosphate sensor kinase, PhoR	0.0046	0.0212	0.5
Mycobacterium ulcerans	two component system membrane associated sensor kinase	0.0046	0.0212	0.5
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0015	0.0027	0.0055
Echinococcus multilocularis	lamin	0.003	0.0116	0.0116
Mycobacterium tuberculosis	Possible two component sensor kinase	0.0046	0.0212	0.5
Loa Loa (eye worm)	RNA binding protein	0.007	0.0362	0.0735
Schistosoma mansoni	opsin-like receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	fmrfamide receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0015	0.0027	0.0027
Brugia malayi	G-protein coupled receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	growth hormone secretagogue receptor	0.0015	0.0027	0.0055
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	serotonin receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Loa Loa (eye worm)	intermediate filament protein	0.003	0.0116	0.0236
Plasmodium falciparum	DNA topoisomerase 2	0.0046	0.0212	0.5
Schistosoma mansoni	lamin	0.003	0.0116	0.0236
Loa Loa (eye worm)	TYRA-2 protein	0.0015	0.0027	0.0055
Trichomonas vaginalis	sensor histidine kinase, putative	0.0046	0.0212	1
Schistosoma mansoni	endoplasmin	0.0046	0.0212	0.043
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0015	0.0027	0.0027
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0015	0.0027	0.0055
Echinococcus multilocularis	sex peptide receptor	0.0015	0.0027	0.0027
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0015	0.0027	0.0055
Schistosoma mansoni	tar DNA-binding protein	0.007	0.0362	0.0735
Brugia malayi	neuropeptide F receptor	0.0015	0.0027	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0019	0.0038
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0027	0.0055
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0015	0.0027	0.0055
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0046	0.0212	0.5
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0046	0.0212	0.7933
Echinococcus multilocularis	neuropeptides capa receptor	0.0015	0.0027	0.0027
Echinococcus multilocularis	integrin linked protein kinase	0.0088	0.0472	0.0472

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 0.67 nM	HEK293DHEK293iHEK293sHEK293pHEK293lHEK293aHEK293cHEK293eHEK293mHEK293eHEK293nHEK293tHEK293 HEK293oHEK293fHEK293 HEK293[HEK2933HEK293HHEK293]HEK293CHEK293PHEK293-HEK2935HEK2935HEK293,HEK2939HEK2934HEK2930HEK293 HEK293fHEK293rHEK293oHEK293mHEK293 HEK293hHEK293uHEK293mHEK293aHEK293nHEK293 HEK293rHEK293eHEK293cHEK293oHEK293mHEK293bHEK293iHEK293nHEK293aHEK293nHEK293tHEK293 HEK293CHEK293BHEK2932HEK293RHEK293 HEK293eHEK293xHEK293pHEK293rHEK293eHEK293sHEK293sHEK293eHEK293dHEK293 HEK293iHEK293nHEK293 HEK293HHEK293EHEK293KHEK293-HEK2932HEK2939HEK2933HEK293 HEK293cHEK293eHEK293lHEK293lHEK293sHEK293 HEK293aHEK293fHEK293tHEK293eHEK293rHEK293 HEK2939HEK2930HEK293 HEK293mHEK293iHEK293nHEK293sHEK293 HEK293bHEK293yHEK293 HEK293lHEK293iHEK293qHEK293uHEK293iHEK293dHEK293 HEK293sHEK293cHEK293iHEK293nHEK293tHEK293iHEK293lHEK293lHEK293aHEK293tHEK293iHEK293oHEK293nHEK293 HEK293cHEK293oHEK293uHEK293nHEK293tHEK293iHEK293nHEK293gHEK293	ChEMBL.	25272206
Ki (binding)	= 3444 nM	HEK293DHEK293iHEK293sHEK293pHEK293lHEK293aHEK293cHEK293eHEK293mHEK293eHEK293nHEK293tHEK293 HEK293oHEK293fHEK293 HEK293[HEK2933HEK293HHEK293]HEK293CHEK293PHEK293-HEK2935HEK2935HEK293,HEK2939HEK2934HEK2930HEK293 HEK293fHEK293rHEK293oHEK293mHEK293 HEK293hHEK293uHEK293mHEK293aHEK293nHEK293 HEK293rHEK293eHEK293cHEK293oHEK293mHEK293bHEK293iHEK293nHEK293aHEK293nHEK293tHEK293 HEK293CHEK293BHEK2931HEK293RHEK293 HEK293eHEK293xHEK293pHEK293rHEK293eHEK293sHEK293sHEK293eHEK293dHEK293 HEK293iHEK293nHEK293 HEK293HHEK293EHEK293KHEK293-HEK2932HEK2939HEK2933HEK293 HEK293cHEK293eHEK293lHEK293lHEK293sHEK293 HEK293aHEK293fHEK293tHEK293eHEK293rHEK293 HEK2939HEK2930HEK293 HEK293mHEK293iHEK293nHEK293sHEK293 HEK293bHEK293yHEK293 HEK293lHEK293iHEK293qHEK293uHEK293iHEK293dHEK293 HEK293sHEK293cHEK293iHEK293nHEK293tHEK293iHEK293lHEK293lHEK293aHEK293tHEK293iHEK293oHEK293nHEK293 HEK293cHEK293oHEK293uHEK293nHEK293tHEK293iHEK293nHEK293gHEK293	ChEMBL.	25272206

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: CHEMBL3353448

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 944580