TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 425.519 | Formula: C23H24FN3O2S
H donors: 0 H acceptors: 2 LogP: 4.04 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Fc1cccc(c1)N1CCN(CC1)CCCN1c2cccc3c2c(S1(=O)=O)ccc3
InChi: 1S/C23H24FN3O2S/c24-19-7-3-8-20(17-19)26-15-13-25(14-16-26)11-4-12-27-21-9-1-5-18-6-2-10-22(23(18)21)30(27,28)29/h1-3,5-10,17H,4,11-16H2
InChiKey: GZVYNCBPEHDVIB-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
Rattus norvegicus	Serotonin 2 (5-HT2) receptor	Starlite/ChEMBL	References
Rattus norvegicus	Adrenergic receptor alpha-1	Starlite/ChEMBL	References
Rattus norvegicus	Dopamine D2 receptor	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

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Loa Loa (eye worm)	hypothetical protein	Dopamine D2 receptor	444 aa	433 aa	21.2 %
Echinococcus multilocularis	neuropeptides capa receptor	Serotonin 2 (5-HT2) receptor	460 aa	408 aa	20.8 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 2 (5-HT2) receptor	460 aa	409 aa	21.8 %
Schistosoma mansoni	biogenic amine (dopamine) receptor	Dopamine D2 receptor	444 aa	494 aa	26.3 %
Echinococcus granulosus	g protein coupled receptor	Dopamine D2 receptor	444 aa	457 aa	21.0 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Serotonin 2 (5-HT2) receptor	460 aa	405 aa	31.1 %
Schistosoma mansoni	amine GPCR	Dopamine D2 receptor	444 aa	424 aa	32.1 %
Echinococcus multilocularis	serotonin receptor	Dopamine D2 receptor	444 aa	428 aa	31.3 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 2 (5-HT2) receptor	460 aa	409 aa	21.5 %
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Dopamine D2 receptor	444 aa	440 aa	30.0 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Dopamine D2 receptor	444 aa	386 aa	19.7 %
Onchocerca volvulus	Glycoprotein hormone beta 5 homolog	Dopamine D2 receptor	444 aa	476 aa	24.2 %
Onchocerca volvulus	RB1-inducible coiled-coil protein 1 homolog	Dopamine D2 receptor	444 aa	474 aa	23.4 %
Echinococcus multilocularis	g protein coupled receptor	Dopamine D2 receptor	444 aa	465 aa	21.5 %
Schistosoma japonicum	ko:K04145 dopamine receptor D2, putative	Dopamine D2 receptor	444 aa	432 aa	30.8 %
Schistosoma mansoni	biogenic amine receptor	Dopamine D2 receptor	444 aa	452 aa	30.1 %
Schistosoma japonicum	Octopamine receptor, putative	Dopamine D2 receptor	444 aa	456 aa	29.4 %
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	Dopamine D2 receptor	444 aa	487 aa	23.8 %
Echinococcus granulosus	biogenic amine 5HT receptor	Dopamine D2 receptor	444 aa	429 aa	31.7 %
Onchocerca volvulus		Dopamine D2 receptor	444 aa	418 aa	23.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	neuropeptide receptor	0.0014	0.1012	0.1119
Echinococcus granulosus	orexin receptor type 2	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0014	0.1012	0.0763
Schistosoma mansoni	cpg binding protein	0.0034	0.3673	0.4349
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0014	0.1012	0.0443
Echinococcus multilocularis	orexin receptor type 2	0.0014	0.1012	0.1193
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0014	0.1012	0.1119
Brugia malayi	PHD-finger family protein	0.0028	0.2858	0.2406
Echinococcus granulosus	G protein coupled receptor 139	0.0014	0.1012	0.1193
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Echinococcus multilocularis	serotonin receptor	0.0014	0.1012	0.1193
Brugia malayi	exodeoxyribonuclease III family protein	0.002	0.1754	0.1232
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0014	0.1012	0.0763
Loa Loa (eye worm)	neuropeptide F receptor	0.0014	0.1012	0.0763
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0014	0.1012	0.1193
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Echinococcus granulosus	tm gpcr rhodopsin	0.0014	0.1012	0.1193
Schistosoma mansoni	ap endonuclease	0.002	0.1754	0.202
Schistosoma mansoni	adenoreceptor	0.0014	0.1012	0.1119
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0035	0.3787	0.5
Brugia malayi	G protein-coupled receptor	0.0014	0.1012	0.0443
Loa Loa (eye worm)	G-protein coupled receptor	0.0014	0.1012	0.0763
Echinococcus granulosus	neuropeptides capa receptor	0.0014	0.1012	0.1193
Brugia malayi	follicle stimulating hormone receptor	0.0014	0.1012	0.0443
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0065	0.7819	1
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0026	0.252	0.295
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0019	0.1593	0.1825
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	biogenic amine 5HT receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.1504	0.1717
Brugia malayi	Bromodomain containing protein	0.004	0.4533	0.4187
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Schistosoma mansoni	neuropeptide f receptor 76f	0.0014	0.1012	0.1119
Treponema pallidum	exodeoxyribonuclease (exoA)	0.002	0.1754	0.5
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	g protein coupled receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	zinc finger protein	0.0022	0.2097	0.2597
Brugia malayi	putative neuropeptide receptor	0.0014	0.1012	0.0443
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.002	0.1754	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.4339	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0014	0.1012	0.0763
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0014	0.1012	0.1193
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0014	0.1012	0.0443
Echinococcus multilocularis	somatostatin receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	neuropeptide Y receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	inositol-1	0.0039	0.4339	0.4536
Brugia malayi	Dopamine receptor protein 2	0.0014	0.1012	0.0443
Echinococcus multilocularis	neuropeptides capa receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.002	0.1754	0.1604
Echinococcus multilocularis	dro:myosuppressin receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	biogenic amine receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	inositol monophosphatase	0.0039	0.4339	0.5157
Loa Loa (eye worm)	hypothetical protein	0.0047	0.5387	0.5725
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.002	0.1754	0.5
Echinococcus granulosus	neuropeptide receptor A26	0.0014	0.1012	0.1193
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Echinococcus granulosus	inositol monophosphatase 1	0.0039	0.4339	0.5498
Brugia malayi	neuropeptide F receptor	0.0014	0.1012	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0075	0.9157	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0014	0.1012	0.1193
Schistosoma mansoni	opsin-like receptor	0.0014	0.1012	0.1119
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	histamine h1 receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0014	0.1012	0.1119
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Brugia malayi	Serotonin receptor	0.0014	0.1012	0.0443
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0039	0.4339	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Echinococcus multilocularis	serotonin receptor	0.0014	0.1012	0.1193
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0035	0.3787	1
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0014	0.1012	0.1193
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0014	0.1012	0.0763
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0018	0.1504	0.183
Schistosoma mansoni	amine GPCR	0.0014	0.1012	0.1119
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.002	0.1754	0.1621
Echinococcus multilocularis	neuropeptide receptor A26	0.0014	0.1012	0.1193
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0014	0.1012	0.1193
Echinococcus granulosus	7TM GPCR rhodopsin	0.0014	0.1012	0.1193
Echinococcus granulosus	tm gpcr rhodopsin	0.0014	0.1012	0.1193
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0014	0.1012	0.0763
Schistosoma mansoni	cpg binding protein	0.0034	0.3673	0.4349
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	neuropeptide receptor	0.0014	0.1012	0.1119
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.4339	1
Echinococcus granulosus	serotonin receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0014	0.1012	0.1119
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0014	0.1012	0.1193
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0065	0.7819	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0019	0.1593	0.1422
Echinococcus multilocularis	fmrfamide receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	fmrfamide receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	neuropeptide F receptor	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	growth hormone secretagogue receptor	0.0014	0.1012	0.1119
Echinococcus multilocularis	g protein coupled receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	neuropeptide s receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	neuropeptide receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0038	0.4196	0.5313
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.002	0.1754	0.2153
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0014	0.1012	0.1193
Echinococcus granulosus	neuropeptides capa receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	tm gpcr rhodopsin	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Brugia malayi	GnHR receptor homolog	0.0014	0.1012	0.0443
Schistosoma mansoni	cpg binding protein	0.003	0.3167	0.3735
Echinococcus multilocularis	g protein coupled receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	cpg binding protein	0.0034	0.3673	0.4637
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	fmrfamide receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.002	0.1754	0.5
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0014	0.1012	0.1119
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0018	0.1504	0.183
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.7168	1
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0014	0.1012	0.0443
Echinococcus multilocularis	sex peptide receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	amine GPCR	0.0014	0.1012	0.1119
Schistosoma mansoni	neuropeptide F-like receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0014	0.1012	0.1119
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0039	0.4339	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0339	0.0323
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0038	0.4196	0.5313
Echinococcus multilocularis	inositol monophosphatase 1	0.0039	0.4339	0.5498
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	hypothetical protein	0.0016	0.1254	0.1413
Brugia malayi	Serotonin receptor	0.0014	0.1012	0.0443
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0039	0.4339	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	ORL1-like opioid receptor	0.0014	0.1012	0.0443
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.1754	0.4042
Echinococcus multilocularis	allatostatin A receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	ap endonuclease	0.002	0.1754	0.202
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	amine GPCR	0.0014	0.1012	0.1119
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	neuropeptide FF receptor 2	0.0014	0.1012	0.1193
Echinococcus granulosus	dro:myosuppressin receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	neuropeptide F receptor	0.0014	0.1012	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0014	0.1012	0.1193
Brugia malayi	putative neuropeptide receptor NPR1	0.0014	0.1012	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Echinococcus multilocularis	g-protein coupled receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	opsin-like receptor	0.0014	0.1012	0.1119
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0014	0.1012	0.1193
Schistosoma mansoni	hypothetical protein	0.0014	0.1012	0.1119
Echinococcus granulosus	g-protein coupled receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0014	0.1012	0.1119
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0339	0.0323
Schistosoma mansoni	hypothetical protein	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0043	0.4881	0.5151
Loa Loa (eye worm)	hypothetical protein	0.004	0.4543	0.4768
Loa Loa (eye worm)	PHD-finger family protein	0.0022	0.2014	0.19
Echinococcus granulosus	g protein coupled receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Brugia malayi	G protein-coupled receptor F59B2.13	0.0014	0.1012	0.0443
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0014	0.1012	0.0443
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0019	0.1593	0.1825
Schistosoma mansoni	zinc finger protein	0.0022	0.2097	0.2437
Brugia malayi	G-protein coupled receptor	0.0014	0.1012	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	zinc finger protein	0.0016	0.1254	0.1413
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Schistosoma mansoni	opsin-like receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	bromodomain containing protein	0.0019	0.1591	0.142
Onchocerca volvulus		0.003	0.3167	1
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0039	0.4339	1
Schistosoma mansoni	neuropeptide receptor	0.0014	0.1012	0.1119
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.4339	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0014	0.1012	0.1193
Echinococcus granulosus	sex peptide receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	G-protein coupled receptor	0.0014	0.1012	0.0763
Echinococcus granulosus	hypothetical protein	0.0014	0.1012	0.1193
Echinococcus granulosus	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Brugia malayi	G-protein coupled receptor	0.0014	0.1012	0.0443
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.4339	1
Brugia malayi	Melatonin receptor type 1A	0.0014	0.1012	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	g protein coupled receptor	0.0014	0.1012	0.1193
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0039	0.4339	0.4774
Brugia malayi	Dopamine receptor	0.0014	0.1012	0.0443
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Schistosoma mansoni	biogenic amine receptor	0.0014	0.1012	0.1119
Echinococcus granulosus	zinc finger protein	0.0022	0.2097	0.2597
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0019	0.1593	0.1946
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	bromodomain containing protein	0.0068	0.8329	1
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.002	0.1754	0.1621
Brugia malayi	CXXC zinc finger family protein	0.003	0.3167	0.2735
Brugia malayi	sulfakinin receptor protein	0.0014	0.1012	0.0443
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0014	0.1012	0.1193
Echinococcus multilocularis	G protein coupled receptor 139	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	hypothetical protein	0.0022	0.2014	0.2336
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0014	0.1012	0.0443
Echinococcus granulosus	neuropeptide Y receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Schistosoma mansoni	biogenic amine receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	CXXC zinc finger family protein	0.003	0.3167	0.3207
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0014	0.1012	0.0443
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.1754	0.4042
Schistosoma mansoni	myosin xvIII	0.0014	0.1012	0.1119
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0014	0.1012	0.1193
Brugia malayi	larval opioid receptor	0.0014	0.1012	0.0443
Echinococcus multilocularis	neuropeptide receptor	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus multilocularis	neuropeptide receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0014	0.1012	0.1119
Brugia malayi	AKH receptor	0.0014	0.1012	0.0443
Schistosoma mansoni	amine GPCR	0.0014	0.1012	0.1119
Schistosoma mansoni	neuropeptide receptor	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.1504	0.1717
Schistosoma mansoni	hypothetical protein	0.0014	0.1012	0.1119
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	histone lysine methyltransferase setb	0.0019	0.1593	0.1946
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Loa Loa (eye worm)	melatonin receptor type 1A	0.0014	0.1012	0.0763
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.002	0.1754	0.1621
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0039	0.4339	1
Echinococcus granulosus	neuropeptide receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0014	0.1012	0.1193
Echinococcus granulosus	somatostatin receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	fetal alzheimer antigen falz	0.0026	0.252	0.3145
Echinococcus multilocularis	neuropeptides capa receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	allatostatin A receptor	0.0014	0.1012	0.1193
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.002	0.1754	0.1621
Brugia malayi	RE15519p	0.0014	0.1012	0.0443
Echinococcus granulosus	neuropeptide s receptor	0.0014	0.1012	0.1193
Schistosoma mansoni	neuropeptide F-like receptor	0.0014	0.1012	0.1119
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0064	0.7758	0.9308
Trichomonas vaginalis	inositol monophosphatase, putative	0.0039	0.4339	1
Schistosoma mansoni	hypothetical protein	0.0014	0.1012	0.1119
Brugia malayi	Inositol-1	0.0039	0.4339	0.3981
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0026	0.252	0.3145
Loa Loa (eye worm)	TYRA-2 protein	0.0014	0.1012	0.0763
Echinococcus granulosus	cpg binding protein	0.0034	0.3673	0.4637
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0014	0.1012	0.1119
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	g protein coupled receptor	0.0014	0.1012	0.1193
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0014	0.1012	0.1193
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0014	0.1012	0.1193
Brugia malayi	hypothetical protein	0.0014	0.1012	0.0443
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.002	0.1754	0.2153
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Echinococcus granulosus	neuropeptide Y receptor	0.0014	0.1012	0.1193
Echinococcus granulosus	7tm_1 domain containing protein	0.0014	0.1012	0.1193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Loa Loa (eye worm)	hypothetical protein	0.0014	0.1012	0.0763
Brugia malayi	Dopamine receptor protein 1	0.0014	0.1012	0.0443
Schistosoma mansoni	amine GPCR	0.0014	0.1012	0.1119
Schistosoma mansoni	inositol monophosphatase	0.0039	0.4339	0.5157

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 18 nM	The concentration required to inhibit [3H]-ketanserin binding to 5-hydroxytryptamine 2 receptor in rat brain membranes (in vitro)	ChEMBL.	1908521
IC50 (binding)	= 18 nM	The concentration required to inhibit [3H]-ketanserin binding to 5-hydroxytryptamine 2 receptor in rat brain membranes (in vitro)	ChEMBL.	1908521
IC50 (binding)	= 688 nM	The concentration required to inhibit [3H]-prazosin binding to Alpha-1 adrenergic receptor in rat brain membranes was measured (in vitro)	ChEMBL.	1908521
IC50 (binding)	= 688 nM	The concentration required to inhibit [3H]-prazosin binding to Alpha-1 adrenergic receptor in rat brain membranes was measured (in vitro)	ChEMBL.	1908521
IC50 (binding)	> 1000 nM	The concentration required to inhibit [3H]-spiperone binding to dopamine receptor D2 in rat brain membranes (in vitro)	ChEMBL.	1908521
IC50 (binding)	> 1000 nM	The concentration required to inhibit [3H]-spiperone binding to dopamine receptor D2 in rat brain membranes (in vitro)	ChEMBL.	1908521

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: CHEMBL415272
PubChem: 15710729

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 135906