TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 219.323 | Formula: C14H21NO
H donors: 0 H acceptors: 0 LogP: 3.11 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccccc1CCN1CCC[C@H]1C
InChi: 1S/C14H21NO/c1-12-6-5-10-15(12)11-9-13-7-3-4-8-14(13)16-2/h3-4,7-8,12H,5-6,9-11H2,1-2H3/t12-/m1/s1
InChiKey: KDVUGYDZNTZESD-GFCCVEGCSA-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	histamine receptor H3	Starlite/ChEMBL	References
Rattus norvegicus	Histamine H3 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	Histamine H3 receptor	445 aa	384 aa	22.4 %
Echinococcus granulosus	biogenic amine 5HT receptor	Histamine H3 receptor	445 aa	405 aa	25.2 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus	Bile acid receptor homolog	0.0164	1	1
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0077	0.411	0.411
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0159	0.0735
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0111	0.6417	0.8837
Loa Loa (eye worm)	glutathione reductase	0.0049	0.2167	0.2041
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Brugia malayi	Steroid receptor seven-up type 2	0.0164	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0164	1	1
Loa Loa (eye worm)	DR-78	0.0077	0.411	0.4015
Brugia malayi	Nuclear hormone receptor-like 1	0.0087	0.4741	0.4741
Brugia malayi	hypothetical protein	0.0077	0.411	0.411
Brugia malayi	RNA binding protein	0.0138	0.8267	0.8267
Trichomonas vaginalis	DNA polymerase eta, putative	0.0019	0.0159	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0159	1
Schistosoma mansoni	nuclear hormone receptor	0.0164	1	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0164	1	1
Brugia malayi	nuclear hormone receptor family member odr-7	0.0077	0.411	0.411
Loa Loa (eye worm)	thioredoxin reductase	0.0049	0.2167	0.2041
Brugia malayi	nuclear receptor RXR	0.0077	0.411	0.411
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0087	0.4741	0.4741
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0164	1	1
Mycobacterium tuberculosis	Probable reductase	0.0111	0.6417	0.8837
Schistosoma mansoni	nuclear receptor nhr-48	0.0077	0.411	0.411
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0087	0.4741	0.4656
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0159	0.0159
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0017	0	0.5
Brugia malayi	MH2 domain containing protein	0.0129	0.7602	0.7602
Mycobacterium tuberculosis	Probable oxidoreductase	0.0124	0.7261	1
Brugia malayi	RNA recognition motif domain containing protein	0.0138	0.8267	0.8267
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0164	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0138	0.8267	0.8267
Brugia malayi	nuclear receptor NHR-88	0.0164	1	1
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0077	0.411	0.411
Brugia malayi	nuclear receptor NHR-88	0.0077	0.411	0.411
Brugia malayi	steroid hormone receptor	0.0164	1	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0138	0.8267	0.8239
Echinococcus multilocularis	nuclear receptor nhr 48	0.0077	0.411	0.411
Brugia malayi	TAR-binding protein	0.0138	0.8267	0.8267
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0164	1	1
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0077	0.411	0.411
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Entamoeba histolytica	hypothetical protein	0.0075	0.3947	1
Entamoeba histolytica	hypothetical protein	0.0075	0.3947	1
Brugia malayi	Thioredoxin reductase	0.0049	0.2167	0.2167
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0077	0.411	0.411
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0124	0.7261	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0164	1	1
Trypanosoma brucei	unspecified product	0.0019	0.0159	0.0735
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0164	1	1
Brugia malayi	nuclear receptor RXR	0.0087	0.4741	0.4741
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0077	0.411	0.411
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0164	1	1
Schistosoma mansoni	thyroid hormone receptor	0.0164	1	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.5161	0.5161
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0049	0.2167	0.2167
Entamoeba histolytica	hypothetical protein	0.0075	0.3947	1
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0049	0.2167	0.2985
Leishmania major	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	hypothetical protein	0.0087	0.4741	0.4741
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0077	0.411	0.4015
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	Nuclear hormone receptor E75	0.0077	0.411	0.411
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0164	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0093	0.5161	0.5161
Echinococcus granulosus	FTZ F1 alpha	0.0164	1	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0129	0.7602	0.7563
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0159	0.0159
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0111	0.6417	0.8837
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0164	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0138	0.8267	0.8267
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0164	1	1
Brugia malayi	orphan nuclear receptor NR2E1	0.0077	0.411	0.411
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0164	1	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0075	0.3947	0.3947
Schistosoma mansoni	nuclear receptor	0.0077	0.411	0.411
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Leishmania major	DNA polymerase eta, putative	0.0019	0.0159	0.0735
Schistosoma mansoni	transcription factor LCR-F1	0.0075	0.3947	0.3947
Brugia malayi	hypothetical protein	0.0077	0.411	0.411
Loa Loa (eye worm)	hypothetical protein	0.0087	0.4741	0.4656
Loa Loa (eye worm)	RNA binding protein	0.0138	0.8267	0.8239
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0159	0.0159
Schistosoma mansoni	hypothetical protein	0.0075	0.3947	0.3947
Leishmania major	trypanothione reductase	0.0049	0.2167	1
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0077	0.411	0.411
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Echinococcus granulosus	ecdysone induced protein 78C	0.0164	1	1
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0017	0	0.5
Schistosoma mansoni	RAR-like nuclear receptor	0.0164	1	1
Brugia malayi	Nuclear hormone receptor E75	0.0077	0.411	0.411
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0159	0.0735
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0164	1	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0164	1	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0093	0.5161	0.5161
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0164	1	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0164	1	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0093	0.5161	0.5083
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0087	0.4741	0.4741
Schistosoma mansoni	coup transcription factor	0.0164	1	1
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0159	0.0735
Brugia malayi	tailless protein	0.0077	0.411	0.411
Loa Loa (eye worm)	nuclear hormone receptor	0.0077	0.411	0.4015
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0093	0.5161	0.5161
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0087	0.4741	0.4656
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0087	0.4741	0.4741
Brugia malayi	ecdysone receptor	0.0077	0.411	0.411
Schistosoma mansoni	nuclear hormone receptor	0.0077	0.411	0.411
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0164	1	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Brugia malayi	nuclear receptor NHR-67	0.0077	0.411	0.411
Loa Loa (eye worm)	hypothetical protein	0.0087	0.4741	0.4656
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0093	0.5161	0.5161
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.5161	0.5161
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0164	1	1
Echinococcus granulosus	dna polymerase eta	0.0019	0.0159	0.0159
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Schistosoma mansoni	nuclear hormone receptor	0.0077	0.411	0.411
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0164	1	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0087	0.4741	0.4741
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0159	0.0159
Echinococcus granulosus	nuclear receptor nhr 48	0.0077	0.411	0.411
Schistosoma mansoni	retinoic acid receptor RXR	0.0164	1	1
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0019	0.0159	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.0159	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0087	0.4741	0.4656
Echinococcus granulosus	thioredoxin glutathione reductase	0.0049	0.2167	0.2167
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0159	0.0735
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0164	1	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Loa Loa (eye worm)	transcription factor SMAD2	0.0129	0.7602	0.7563
Toxoplasma gondii	thioredoxin reductase	0.0049	0.2167	1
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0159	0.0159
Brugia malayi	Nuclear hormone receptor-like 1	0.0087	0.4741	0.4741
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0164	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0164	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0164	1	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0075	0.3947	0.3947
Treponema pallidum	NADH oxidase	0.0017	0	0.5
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0077	0.411	0.411
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0164	1	1
Brugia malayi	conserved hypotetical protein	0.0077	0.411	0.411
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0077	0.411	0.411
Trypanosoma brucei	trypanothione reductase	0.0049	0.2167	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0087	0.4741	0.4656
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Mycobacterium tuberculosis	Probable dehydrogenase	0.0111	0.6417	0.8837
Schistosoma mansoni	tar DNA-binding protein	0.0138	0.8267	0.8267
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Plasmodium falciparum	glutathione reductase	0.0049	0.2167	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0164	1	1
Entamoeba histolytica	hypothetical protein	0.0075	0.3947	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	hypothetical protein	0.0087	0.4741	0.4741
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0164	1	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0077	0.411	0.411
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0164	1	1
Giardia lamblia	DINP protein human, muc B family	0.0019	0.0159	1
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0159	0.0159
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0093	0.5161	0.5161
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.0159	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0077	0.411	0.411
Schistosoma mansoni	nuclear receptor	0.0077	0.411	0.411
Plasmodium falciparum	thioredoxin reductase	0.0049	0.2167	1
Brugia malayi	nuclear hormone receptor	0.0164	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0164	1	1
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0077	0.411	0.411
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0077	0.411	0.411
Plasmodium vivax	glutathione reductase, putative	0.0049	0.2167	1
Onchocerca volvulus		0.0164	1	1
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0159	0.0159
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Brugia malayi	nuclear hormone receptor	0.0077	0.411	0.411
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0159	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0159	0.0159
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0164	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0138	0.8267	0.8267
Schistosoma mansoni	thyroid hormone receptor	0.0164	1	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0093	0.5161	0.5161
Brugia malayi	photoreceptor-specific nuclear receptor	0.0164	1	1
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0164	1	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0164	1	1
Brugia malayi	glutathione reductase	0.0049	0.2167	0.2167
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0164	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.0159	0.0219
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0164	1	1
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0159	0.0159
Trypanosoma cruzi	trypanothione reductase, putative	0.0049	0.2167	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0164	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0164	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0164	1	1
Loa Loa (eye worm)	hypothetical protein	0.0077	0.411	0.4015
Echinococcus multilocularis	tar DNA binding protein	0.0138	0.8267	0.8267
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Schistosoma mansoni	zinc finger protein	0.0077	0.411	0.411
Echinococcus granulosus	thyroid hormone receptor alpha	0.0077	0.411	0.411
Loa Loa (eye worm)	TAR-binding protein	0.0138	0.8267	0.8239
Schistosoma mansoni	tar DNA-binding protein	0.0138	0.8267	0.8267
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0124	0.7261	1
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0159	0.0159
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Onchocerca volvulus	Protein ultraspiracle homolog	0.0164	1	1
Echinococcus multilocularis	FTZ F1 alpha	0.0164	1	1
Loa Loa (eye worm)	steroid hormone receptor	0.0164	1	1
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0077	0.411	0.4015
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.0159	0.0219
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0017	0	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0164	1	1
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0111	0.6417	0.8837
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0077	0.411	0.411
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0111	0.6417	0.8837
Echinococcus granulosus	tar DNA binding protein	0.0138	0.8267	0.8267
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0124	0.7261	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0159	0.0735
Brugia malayi	hypothetical protein	0.0075	0.3947	0.3947
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0164	1	1
Plasmodium vivax	thioredoxin reductase, putative	0.0049	0.2167	1
Loa Loa (eye worm)	hypothetical protein	0.0164	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0164	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 35 nM	Binding affinity at human recombinant histamine H3 receptor expressed in HEK cells	ChEMBL.	18077160
Ki (binding)	= 35 nM	Binding affinity at human recombinant histamine H3 receptor expressed in HEK cells	ChEMBL.	18077160
Ki (binding)	= 110 nM	Binding affinity at rat recombinant histamine H3 receptor in rat cortical membranes	ChEMBL.	18077160
Ki (binding)	= 110 nM	Binding affinity at rat recombinant histamine H3 receptor in rat cortical membranes	ChEMBL.	18077160

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: CHEMBL404375

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 521590