TDR Targets

Basic information

Technical information

TDR Targets ID: 52151
Name: N-methyl-2-[3-(1-methylindol-3-yl)-1,2,4-oxad iazol-5-yl]ethanamine
MW: 256.303 | Formula: C14H16N4O
H donors: 1 H acceptors: 2 LogP: 1.75 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CNCCc1onc(n1)c1cn(c2c1cccc2)C
InChi: 1S/C14H16N4O/c1-15-8-7-13-16-14(17-19-13)11-9-18(2)12-6-4-3-5-10(11)12/h3-6,9,15H,7-8H2,1-2H3
InChiKey: IKOYNKLYHKKYIX-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

N-methyl-2-[3-(1-methyl-3-indolyl)-1,2,4-oxadiazol-5-yl]ethanamine
methyl-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]amine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Serotonin 3 (5-HT3) 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
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	Serotonin 3 (5-HT3) receptor	483 aa	445 aa	25.4 %
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	Serotonin 3 (5-HT3) receptor	483 aa	503 aa	22.3 %
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	Serotonin 3 (5-HT3) receptor	483 aa	482 aa	23.9 %
Brugia malayi	Cation transporter family protein	Serotonin 3 (5-HT3) receptor	483 aa	507 aa	28.2 %
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	Serotonin 3 (5-HT3) receptor	483 aa	478 aa	25.1 %
Onchocerca volvulus	Large subunit GTPase 1 homolog	Serotonin 3 (5-HT3) receptor	483 aa	394 aa	19.3 %
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	Serotonin 3 (5-HT3) receptor	483 aa	484 aa	26.0 %
Onchocerca volvulus		Serotonin 3 (5-HT3) receptor	483 aa	489 aa	31.3 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type des-2 homolog	Serotonin 3 (5-HT3) receptor	483 aa	464 aa	24.8 %
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	Serotonin 3 (5-HT3) receptor	483 aa	470 aa	27.7 %
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	Serotonin 3 (5-HT3) receptor	483 aa	457 aa	26.9 %
Onchocerca volvulus		Serotonin 3 (5-HT3) receptor	483 aa	461 aa	24.3 %
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	Serotonin 3 (5-HT3) receptor	483 aa	387 aa	25.6 %
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	Serotonin 3 (5-HT3) receptor	483 aa	514 aa	23.2 %
Onchocerca volvulus		Serotonin 3 (5-HT3) receptor	483 aa	477 aa	26.6 %
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	Serotonin 3 (5-HT3) receptor	483 aa	457 aa	26.7 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Serotonin 3 (5-HT3) receptor	483 aa	465 aa	27.3 %
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-3 precursor, putative	Serotonin 3 (5-HT3) receptor	483 aa	505 aa	21.2 %
Echinococcus multilocularis	nAChR subunit	Serotonin 3 (5-HT3) receptor	483 aa	495 aa	24.2 %
Onchocerca volvulus	Putative zinc finger protein	Serotonin 3 (5-HT3) receptor	483 aa	489 aa	25.8 %
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	Serotonin 3 (5-HT3) receptor	483 aa	463 aa	26.8 %
Onchocerca volvulus		Serotonin 3 (5-HT3) receptor	483 aa	452 aa	29.2 %
Schistosoma japonicum	Neuronal acetylcholine receptor subunit alpha-9-II precursor, putative	Serotonin 3 (5-HT3) receptor	483 aa	457 aa	24.7 %
Onchocerca volvulus		Serotonin 3 (5-HT3) receptor	483 aa	473 aa	27.5 %
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	Serotonin 3 (5-HT3) receptor	483 aa	470 aa	26.8 %
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	Serotonin 3 (5-HT3) receptor	483 aa	388 aa	21.9 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Serotonin 3 (5-HT3) receptor	483 aa	482 aa	25.1 %
Onchocerca volvulus	Acetylcholine receptor subunit alpha-type homolog	Serotonin 3 (5-HT3) receptor	483 aa	465 aa	27.3 %
Drosophila melanogaster	nicotinic Acetylcholine Receptor alpha2	Serotonin 3 (5-HT3) receptor	483 aa	541 aa	25.5 %
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	Serotonin 3 (5-HT3) receptor	483 aa	445 aa	25.6 %
Onchocerca volvulus	39S ribosomal protein L13, mitochondrial homolog	Serotonin 3 (5-HT3) receptor	483 aa	490 aa	31.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus granulosus	roundabout 2	0.0021	0.006	0.0087
Echinococcus granulosus	insulin growth factor binding	0.0021	0.006	0.0087
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Trypanosoma cruzi	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.1014	1	1
Echinococcus multilocularis	leucine rich repeats and immunoglobulin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Echinococcus granulosus	tyrosine protein kinase transmembrane receptor	0.0029	0.0135	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus multilocularis	titin	0.0021	0.006	0.0087
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Loa Loa (eye worm)	CAMK protein kinase	0.0021	0.006	0.006
Echinococcus multilocularis	twitchin	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0538	0.5231	0.5231
Loa Loa (eye worm)	disorganized muscle protein 1	0.0021	0.006	0.006
Brugia malayi	Wrapper/rega-1/klingon homolog protein 1	0.0021	0.006	0.006
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus multilocularis	neuroglian	0.0021	0.006	0.0087
Echinococcus granulosus	titin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0728	0.7138	0.7138
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	roundabout 2	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Plasmodium falciparum	polyprenol reductase, putative	0.0538	0.5231	0.5
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Echinococcus granulosus	3 oxo 5 alpha steroid 4 dehydrogenase C terminal	0.0538	0.5231	0.7552
Echinococcus multilocularis	basic fibroblast growth factor receptor 1 A	0.0707	0.6927	1
Echinococcus multilocularis	titin	0.0021	0.006	0.0087
Onchocerca volvulus	Peroxidasin homolog	0.0021	0.006	0.0115
Echinococcus multilocularis	pro neuregulin 2, membrane bound	0.0021	0.006	0.0087
Echinococcus granulosus	roundabout 2	0.0021	0.006	0.0087
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0021	0.006	0.0087
Brugia malayi	Animal haem peroxidase family protein	0.0021	0.006	0.006
Loa Loa (eye worm)	TK protein kinase	0.0728	0.7138	0.7138
Echinococcus multilocularis	peroxidasin	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Schistosoma mansoni	nephrin	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0021	0.006	0.0087
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0021	0.006	0.0087
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Schistosoma mansoni	slit	0.0021	0.006	0.0087
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Echinococcus granulosus	Opioid binding protein:cell adhesion molecule	0.0021	0.006	0.0087
Schistosoma mansoni	myosin-binding protein-related	0.0021	0.006	0.0087
Onchocerca volvulus	Putative titin	0.0021	0.006	0.0115
Echinococcus multilocularis	lachesin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	tyrosine protein kinase transmembrane receptor	0.0029	0.0135	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Prion-like-	0.0021	0.006	0.006
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus granulosus	lachesin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Schistosoma mansoni	neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Brugia malayi	Myb-like DNA-binding domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	tyrosine kinase	0.0707	0.6927	1
Onchocerca volvulus	Netrin receptor homolog	0.0021	0.006	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus granulosus	neuroglian	0.0021	0.006	0.0087
Onchocerca volvulus		0.0538	0.5231	1
Brugia malayi	Peroxidasin	0.0021	0.006	0.006
Echinococcus granulosus	titin	0.0021	0.006	0.0087
Echinococcus multilocularis	roundabout 2	0.0021	0.006	0.0087
Echinococcus granulosus	leucine rich repeats and immunoglobulin	0.0021	0.006	0.0087
Echinococcus granulosus	basic fibroblast growth factor receptor 1 A	0.0707	0.6927	1
Trypanosoma brucei	3-oxo-5-alpha-steroid 4-dehydrogenase-like, putative	0.1014	1	1
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Echinococcus multilocularis	Opioid binding protein:cell adhesion molecule	0.0021	0.006	0.0087
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Echinococcus granulosus	titin	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Schistosoma mansoni	septate junction protein	0.0021	0.006	0.0087
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Echinococcus multilocularis	neurotracting:lsamp:neurotrimin:obcam	0.0021	0.006	0.0087
Plasmodium falciparum	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.0538	0.5231	0.5
Schistosoma mansoni	hemicentin	0.0021	0.006	0.0087
Loa Loa (eye worm)	one IG domain family member	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus granulosus	leucine rich repeat containing protein 4	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Onchocerca volvulus		0.0021	0.006	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Echinococcus granulosus	roundabout 2	0.0021	0.006	0.0087
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0021	0.006	0.006
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	transfer RNA-Phe	0.0021	0.006	0.0087
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0021	0.006	0.0087
Schistosoma mansoni	cell adhesion molecule	0.0021	0.006	0.0087
Brugia malayi	Prion-like-	0.0021	0.006	0.006
Echinococcus multilocularis	tyrosine protein kinase otk	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Schistosoma mansoni	synaptic glycoprotein sc2 related	0.0538	0.5231	0.7552
Loa Loa (eye worm)	projectin	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	subfamily M23B non-peptidase homologue (M23 family)	0.0021	0.006	0.0087
Plasmodium vivax	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.0538	0.5231	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Onchocerca volvulus	Peroxidasin homolog	0.0021	0.006	0.0115
Trichomonas vaginalis	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.1014	1	1
Brugia malayi	protein unc-22	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Giardia lamblia	Synaptic glycoprotein SC2	0.0538	0.5231	0.5
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Echinococcus granulosus	synaptic glycoprotein sc2	0.0538	0.5231	0.7552
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Brugia malayi	Disorganized muscle protein 1	0.0021	0.006	0.006
Entamoeba histolytica	steroid 5-alpha reductase, putative	0.1014	1	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus granulosus	titin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	neuroglian	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Loa Loa (eye worm)	animal heme peroxidase	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Schistosoma mansoni	septate junction protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	roundabout 2	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	roundabout	0.0021	0.006	0.0087
Echinococcus granulosus	twitchin	0.0021	0.006	0.0087
Echinococcus multilocularis	titin	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Loa Loa (eye worm)	TK/ROR protein kinase	0.0029	0.0135	0.0135
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Schistosoma mansoni	nephrin related	0.0021	0.006	0.0087
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Synaptic glycoprotein SC2	0.0538	0.5231	0.5231
Echinococcus multilocularis	contactin neuroglian septate junction protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	hemicentin 1	0.0021	0.006	0.0087
Echinococcus granulosus	neuroglian	0.0021	0.006	0.0087
Echinococcus granulosus	tyrosine protein kinase otk	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Trichomonas vaginalis	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.1014	1	1
Onchocerca volvulus	Tyrosine kinase homolog	0.0029	0.0135	0.0259
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Onchocerca volvulus	Basement membrane proteoglycan homolog	0.0021	0.006	0.0115
Echinococcus granulosus	pro neuregulin 2 membrane bound	0.0021	0.006	0.0087
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	insulin growth factor binding	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis	3 oxo 5 alpha steroid 4 dehydrogenase, C terminal	0.0538	0.5231	0.7552
Onchocerca volvulus		0.0021	0.006	0.0115
Schistosoma mansoni	tyrosine kinase	0.0029	0.0135	0.0195
Schistosoma mansoni	synaptic glycoprotein sc2 related	0.0538	0.5231	0.7552
Mycobacterium ulcerans	hypothetical protein	0.1014	1	0.5
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Toxoplasma gondii	3-oxo-5-alpha-steroid 4-dehydrogenase	0.1014	1	1
Trypanosoma cruzi	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.1014	1	1
Loa Loa (eye worm)	hypothetical protein	0.1014	1	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0021	0.006	0.006
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Echinococcus multilocularis		0.0021	0.006	0.0087
Brugia malayi	Prion-like-	0.0021	0.006	0.006
Echinococcus multilocularis	down syndrome cell adhesion	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Trichomonas vaginalis	3-oxo-5-alpha-steroid 4-dehydrogenase, putative	0.1014	1	1
Echinococcus granulosus	fibroblast growth factor receptor 4	0.0707	0.6927	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	nephrin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Prion-like-	0.0021	0.006	0.006
Schistosoma mansoni	hypothetical protein	0.0021	0.006	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0538	0.5231	0.5231
Echinococcus granulosus	down syndrome cell adhesion	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Echinococcus granulosus	nephrin	0.0021	0.006	0.0087
Echinococcus granulosus	peroxidasin	0.0021	0.006	0.0087
Schistosoma mansoni	titin	0.0021	0.006	0.0087
Echinococcus granulosus	hemicentin 1	0.0021	0.006	0.0087
Onchocerca volvulus		0.0021	0.006	0.0115
Echinococcus multilocularis	titin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Schistosoma mansoni	neuroglian	0.0021	0.006	0.0087
Echinococcus granulosus	titin	0.0021	0.006	0.0087
Plasmodium vivax	polyprenol reductase, putative	0.0538	0.5231	0.5
Echinococcus multilocularis	hemicentin 1	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Brugia malayi	Leucine Rich Repeat family protein	0.0021	0.006	0.006
Loa Loa (eye worm)	hypothetical protein	0.0021	0.006	0.006
Onchocerca volvulus		0.0021	0.006	0.0115
Echinococcus granulosus	contactin	0.0021	0.006	0.0087
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.006	0.006
Leishmania major	3-oxo-5-alpha-steroid 4-dehydrogenase-like protein	0.1014	1	0.5
Echinococcus multilocularis	synaptic glycoprotein sc2	0.0538	0.5231	0.7552
Echinococcus multilocularis	fibroblast growth factor receptor 4	0.0707	0.6927	1
Brugia malayi	kettin	0.0021	0.006	0.006

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= -7.07	Displacement of [3H]-Q-ICS 205-930 binding to 5-hydroxytryptamine 3 receptor recognition sites in rat brain membranes.	ChEMBL.	1992112
Log IC50 (binding)	= 7.07	Displacement of [3H]-Q-ICS 205-930 binding to 5-hydroxytryptamine 3 receptor recognition sites in rat brain membranes.	ChEMBL.	1992112
pKa	= 8.8	pKa value of the compound.	ChEMBL.	1992112

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

PubChem: 14810846

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 52151