TDR Targets

Basic information

Technical information

TDR Targets ID: 183560
Name: 5-[4-[3-(trifluoromethyl)phenyl]butyl]-1H-imi dazole
MW: 268.278 | Formula: C14H15F3N2
H donors: 1 H acceptors: 1 LogP: 4.1 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: FC(c1cccc(c1)CCCCc1c[nH]cn1)(F)F
InChi: 1S/C14H15F3N2/c15-14(16,17)12-6-3-5-11(8-12)4-1-2-7-13-9-18-10-19-13/h3,5-6,8-10H,1-2,4,7H2,(H,18,19)
InChiKey: BEIQLZSLCJDKHP-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

4-[4-[3-(trifluoromethyl)phenyl]butyl]-3H-imidazole

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
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
Echinococcus granulosus	biogenic amine 5HT receptor	Histamine H3 receptor	445 aa	405 aa	25.2 %
Loa Loa (eye worm)	hypothetical protein	Histamine H3 receptor	445 aa	384 aa	22.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus		0.0094	0.0491	0.2389
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0051	0.0195	0.0684
Toxoplasma gondii	eukaryotic initiation factor-4E, putative	0.0401	0.2571	1
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB	0.0044	0.0147	0.3198
Echinococcus granulosus	p2X purinoceptor 4	0.0279	0.1746	0.6787
Trypanosoma cruzi	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Leishmania major	eukaryotic translation initiation factor 4e, putative	0.0048	0.0176	0.0672
Loa Loa (eye worm)	fatty acid synthase	0.0053	0.0214	0.076
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E type 5, putative	0.0048	0.0176	0.0672
Giardia lamblia	Translation elongation factor	0.0048	0.0176	0.367
Trichomonas vaginalis	eukaryotic translation initiation factor 4E type, putative	0.0048	0.0176	0.0672
Toxoplasma gondii	type I fatty acid synthase, putative	0.0058	0.0242	0.093
Trypanosoma brucei	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Mycobacterium tuberculosis	Probable multifunctional mycocerosic acid synthase membrane-associated Mas	0.0058	0.0242	0.6033
Mycobacterium leprae	Probable hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (IMP pho	0.007	0.0328	0.803
Mycobacterium leprae	Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas	0.0058	0.0242	0.5736
Giardia lamblia	Hypothetical protein	0.0048	0.0176	0.367
Mycobacterium tuberculosis	Probable membrane bound polyketide synthase Pks6	0.0081	0.0401	1
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.058
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0176	0.0672
Mycobacterium tuberculosis	Polyketide synthase Pks2	0.0053	0.0208	0.5182
Schistosoma mansoni	hypothetical protein	0.0052	0.0201	0.0198
Trypanosoma brucei	Eukaryotic translation initiation factor 4E-1	0.0401	0.2571	1
Trypanosoma brucei	ingi protein (ORF1)	0.0031	0.006	0.0221
Leishmania major	eukaryotic translation initiation factor-like protein	0.0401	0.2571	1
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA	0.0054	0.0219	0.5124
Schistosoma mansoni	P2X receptor subunit	0.0138	0.0791	0.0788
Echinococcus multilocularis	hypoxanthine guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Leishmania major	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Entamoeba histolytica	hypothetical protein	0.0048	0.0176	0.058
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Leishmania major	hypothetical protein, conserved	0.0048	0.0176	0.0672
Mycobacterium ulcerans	polyketide synthase	0.0058	0.0242	0.4807
Brugia malayi	hypothetical protein	0.0253	0.1567	0.609
Trypanosoma brucei	unspecified product	0.0031	0.006	0.0221
Onchocerca volvulus		0.0092	0.0473	0.2299
Giardia lamblia	Hypothetical protein	0.0048	0.0176	0.367
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0065	0.0292	0.1125
Loa Loa (eye worm)	translation initiation factor 4E	0.0401	0.2571	1
Schistosoma mansoni	hypothetical protein	0.0369	0.2359	0.2356
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsD	0.0054	0.0219	0.5463
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.058
Mycobacterium ulcerans	thioesterase TesA	0.0045	0.0158	0.2917
Schistosoma mansoni	survival motor neuron protein	0.0052	0.0201	0.0198
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0026	0.0028	0.5
Trypanosoma cruzi	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Loa Loa (eye worm)	eukaryotic translation initiation factor 4E-1	0.0048	0.0176	0.0608
Mycobacterium leprae	Probable polyketide synthase Pks1	0.0058	0.0242	0.5736
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0093	0.0479	0.1855
Brugia malayi	Beta-ketoacyl synthase, N-terminal domain containing protein	0.0054	0.0219	0.0841
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0051	0.0195	0.4861
Mycobacterium ulcerans	polyketide synthase	0.0054	0.0219	0.4294
Echinococcus granulosus	ras gtpase	0.0149	0.0863	0.3347
Schistosoma mansoni	P2X receptor subunit	0.0279	0.1746	0.1744
Schistosoma mansoni	P2X receptor subunit	0.0279	0.1746	0.1744
Mycobacterium tuberculosis	Probable polyketide synthase Pks7	0.0058	0.0242	0.6033
Schistosoma mansoni	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	0.047
Mycobacterium tuberculosis	Probable polyketide synthase Pks8	0.0044	0.0152	0.3792
Brugia malayi	oxidoreductase, zinc-binding dehydrogenase family protein	0.0103	0.0548	0.2124
Giardia lamblia	Telomerase catalytic subunit	0.0086	0.0436	0.9204
Plasmodium falciparum	eukaryotic translation initiation factor 4E	0.0048	0.0176	0.3316
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Trypanosoma cruzi	telomerase reverse transcriptase, putative	0.0086	0.0436	0.1685
Trypanosoma brucei	RNA helicase, putative	0.0369	0.2359	0.9171
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE	0.0036	0.0094	0.1784
Echinococcus multilocularis	ras gtpase	0.0149	0.0863	0.3347
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0176	0.0672
Trypanosoma cruzi	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.0292	0.5928
Loa Loa (eye worm)	hypothetical protein	0.003	0.0057	0.0145
Toxoplasma gondii	aldehyde dehydrogenase	0.0065	0.0292	0.1125
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0176	0.0672
Leishmania major	telomerase reverse transcriptase, putative	0.0086	0.0436	0.1685
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0093	0.0479	0.0477
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsD	0.0054	0.0219	0.4294
Leishmania major	eukaryotic translation initiation factor eIF-4E, putative	0.0401	0.2571	1
Mycobacterium tuberculosis	Probable polyketide synthase Pks1	0.0039	0.0115	0.288
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0065	0.0292	0.7278
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-1	0.0401	0.2571	1
Schistosoma mansoni	cell polarity protein	0.0149	0.0863	0.086
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0026	0.0028	1
Toxoplasma gondii	hypothetical protein	0.0048	0.0176	0.0672
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Trypanosoma brucei	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Leishmania major	eukaryotic translation initiation factor-like	0.0401	0.2571	1
Onchocerca volvulus	Telomerase reverse transcriptase homolog	0.0324	0.2048	1
Trichomonas vaginalis	eukaryotic translation initiation factor 4E type, putative	0.0048	0.0176	0.0672
Entamoeba histolytica	eukaryotic initiation factor 4E, putative	0.0048	0.0176	0.058
Mycobacterium leprae	Polyketide synthase Pks13	0.0081	0.0401	1
Leishmania major	eukaryotic translation initiation factor, putative	0.0048	0.0176	0.0672
Giardia lamblia	hypothetical protein	0.0048	0.0176	0.367
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Plasmodium vivax	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	1
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0054	0.0219	0.4294
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsC	0.0054	0.0219	0.5463
Entamoeba histolytica	hypothetical protein	0.0048	0.0176	0.058
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0054	0.0219	0.4294
Onchocerca volvulus		0.0051	0.0195	0.0939
Plasmodium falciparum	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	1
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC	0.0058	0.0242	0.5736
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Trypanosoma brucei	Eukaryotic translation initiation factor 4E-2	0.0048	0.0176	0.0672
Toxoplasma gondii	eukaryotic initiation factor-4E, putative	0.0048	0.0176	0.0672
Echinococcus multilocularis	p2X purinoceptor 4	0.0279	0.1746	0.6787
Trypanosoma brucei	retrotransposon hot spot protein 4 (RHS4), interrupted	0.0031	0.006	0.0221
Trypanosoma brucei	ingi protein (ORF1)	0.0031	0.006	0.0221
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.058
Plasmodium falciparum	telomerase reverse transcriptase	0.0086	0.0436	0.916
Onchocerca volvulus		0.0052	0.0201	0.0969
Trichomonas vaginalis	hypothetical protein	0.0048	0.0176	0.0672
Toxoplasma gondii	RNA-directed DNA polymerase	0.0086	0.0436	0.1685
Trypanosoma cruzi	telomerase reverse transcriptase, putative	0.0086	0.0436	0.1685
Mycobacterium ulcerans	hypoxanthine-guanine phosphoribosyltransferase Hpt	0.0092	0.0473	1
Giardia lamblia	Guanine phosphoribosyltransferase	0.0092	0.0473	1
Mycobacterium tuberculosis	Probable polyketide synthase Pks9	0.0031	0.006	0.1505
Mycobacterium leprae	PROBABLE THIOESTERASE TESA	0.0045	0.0158	0.348
Mycobacterium tuberculosis	Probable thioesterase TesA	0.0045	0.0158	0.3934
Echinococcus granulosus	expressed protein	0.0399	0.256	0.9955
Echinococcus granulosus	p2X purinoceptor 4	0.0279	0.1746	0.6787
Mycobacterium ulcerans	thioesterase	0.0045	0.0158	0.2917
Entamoeba histolytica	eukaryotic initiation factor 4E, putative	0.0048	0.0176	0.058
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsC	0.0058	0.0242	0.4807
Onchocerca volvulus	Fatty acid synthase homolog	0.0098	0.0514	0.2501
Trypanosoma cruzi	eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative	0.0048	0.0176	0.0672
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.0292	0.5928
Schistosoma mansoni	cell polarity protein	0.0149	0.0863	0.086
Trypanosoma brucei	Eukaryotic translation initiation factor 4E-3	0.0048	0.0176	0.0672
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD	0.0054	0.0219	0.5124
Onchocerca volvulus	Putative eukaryotic translation initiation factor 4e	0.0048	0.0176	0.0844
Echinococcus granulosus	L aminoadipate semialdehyde	0.0093	0.0479	0.1855
Plasmodium vivax	translation initiation factor 4E, putative	0.0048	0.0176	0.3316
Echinococcus granulosus	eukaryotic translation initiation factor 4E	0.0401	0.2571	1
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Schistosoma mansoni	eukaryotic translation initiation factor 4e	0.0401	0.2571	0.2569
Trypanosoma brucei	telomerase reverse transcriptase	0.0086	0.0436	0.1685
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Mycobacterium tuberculosis	Hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (imp pyrophosphor	0.007	0.0328	0.8167
Echinococcus granulosus	survival motor neuron protein 1	0.0253	0.1567	0.609
Echinococcus multilocularis	p2X purinoceptor 4	0.0279	0.1746	0.6787
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0026	0.0028	0.0097
Trichomonas vaginalis	eukaryotic translation initiation factor 4E type, putative	0.0048	0.0176	0.0672
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Loa Loa (eye worm)	eukaryotic translation initiation factor 4E type 3	0.0048	0.0176	0.0608
Brugia malayi	Telomerase reverse transcriptase	0.0229	0.1407	0.5465
Trypanosoma brucei	hypothetical protein, conserved	0.0031	0.006	0.0221
Trypanosoma cruzi	eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative	0.0048	0.0176	0.0672
Schistosoma mansoni	aldehyde dehydrogenase	0.0065	0.0292	0.0289
Brugia malayi	GTP-binding protein, identical	0.0149	0.0863	0.3347
Leishmania major	phosphopantetheinyl transferase-like protein	0.0026	0.0028	0.0097
Trichomonas vaginalis	eukaryotic translation initiation factor 4E type, putative	0.0048	0.0176	0.0672
Toxoplasma gondii	beta-ketoacyl synthase, N-terminal domain-containing protein	0.0035	0.009	0.0338
Brugia malayi	GTP-binding protein	0.0149	0.0863	0.3347
Plasmodium vivax	telomerase reverse transcriptase, putative	0.0086	0.0436	0.916
Echinococcus multilocularis	survival motor neuron protein 1	0.0253	0.1567	0.609
Mycobacterium ulcerans	polyketide synthase Pks9	0.0036	0.0094	0.1495
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0093	0.0479	0.1855
Mycobacterium ulcerans	multifunctional mycocerosic acid synthase membrane-associated Mas	0.0058	0.0242	0.4807
Schistosoma mansoni	aldehyde dehydrogenase	0.0065	0.0292	0.0289
Mycobacterium tuberculosis	Probable polyketide synthase Pks5	0.0053	0.0208	0.5182
Echinococcus granulosus	p2X purinoceptor 4	0.0279	0.1746	0.6787
Brugia malayi	Phosphoribosyl transferase domain containing protein	0.0092	0.0473	0.183
Mycobacterium ulcerans	polyketide synthase Pks13	0.0081	0.0401	0.838
Brugia malayi	translation initiation factor 4E	0.0401	0.2571	1
Trichomonas vaginalis	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0065	0.0292	0.1125
Trypanosoma brucei	hypothetical protein, conserved	0.0026	0.0028	0.0097
Leishmania major	xanthine phosphoribosyltransferase	0.0092	0.0473	0.183
Schistosoma mansoni	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	0.047
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.0672
Toxoplasma gondii	hypoxanthine-xanthine-guanine phosphoribosyl transferase HXGPRT	0.0092	0.0473	0.183
Leishmania major	hypothetical protein, conserved	0.0048	0.0176	0.0672
Echinococcus granulosus	hypoxanthine guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Toxoplasma gondii	AMP-binding enzyme domain-containing protein	0.0027	0.0037	0.0133
Mycobacterium tuberculosis	Phenolpthiocerol synthesis type-I polyketide synthase PpsA	0.0054	0.0219	0.5463
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0026	0.0028	0.0097
Trypanosoma brucei	Eukaryotic translation initiation factor 4E type 5	0.0048	0.0176	0.0672
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Echinococcus granulosus	hypoxanthine guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Trypanosoma brucei	Eukaryotic translation initiation factor 4E-4	0.0048	0.0176	0.0672
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-1	0.0401	0.2571	1
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-4	0.0048	0.0176	0.0672
Entamoeba histolytica	translation initiation factor 4e, putative	0.0048	0.0176	0.058
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsB	0.0044	0.0147	0.268
Plasmodium falciparum	eukaryotic translation initiation factor 4E, putative	0.0048	0.0176	0.3316
Schistosoma mansoni	P2X receptor subunit	0.0138	0.0791	0.0788
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0469	0.1759
Brugia malayi	eukaryotic translation initiation factor 4E-1	0.0048	0.0176	0.0672
Echinococcus multilocularis	expressed protein	0.0399	0.256	0.9955
Trypanosoma brucei	hypoxanthine-guanine phosphoribosyltransferase	0.0092	0.0473	0.183
Echinococcus multilocularis	p2X purinoceptor 4	0.0279	0.1746	0.6787
Plasmodium vivax	hypothetical protein, conserved	0.0048	0.0176	0.3316
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0065	0.0292	0.1125
Echinococcus granulosus	eukaryotic translation initiation factor 4E type	0.0048	0.0176	0.0672
Trypanosoma cruzi	hypoxanthine-guanine phosphoribosyltransferase, putative	0.0092	0.0473	0.183
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0065	0.0292	0.5928
Mycobacterium tuberculosis	Polyketide synthase Pks12	0.0058	0.0242	0.6033
Brugia malayi	Eukaryotic translation initiation factor 4E type 3, putative	0.0048	0.0176	0.0672
Brugia malayi	AMP-binding enzyme family protein	0.0051	0.0195	0.0747
Mycobacterium ulcerans	Type I modular polyketide synthase	0.0054	0.0219	0.4294
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0026	0.0028	1
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-3	0.0048	0.0176	0.0672
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0401	0.2571	1
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-4	0.0048	0.0176	0.0672
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E type 5, putative	0.0048	0.0176	0.0672
Loa Loa (eye worm)	hypothetical protein	0.0253	0.1567	0.6063
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0479	0.1799
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsA	0.0044	0.0147	0.268
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0026	0.0028	0.0696
Toxoplasma gondii	type I fatty acid synthase, putative	0.0039	0.0113	0.0429
Echinococcus multilocularis	eukaryotic translation initiation factor 4E	0.0401	0.2571	1
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0052	0.0201	0.0772
Onchocerca volvulus		0.0093	0.0479	0.233
Loa Loa (eye worm)	GTP-binding protein	0.0149	0.0863	0.3302
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsE	0.0036	0.0094	0.1495
Mycobacterium tuberculosis	Polyketide synthase Pks13	0.0081	0.0401	1
Trichomonas vaginalis	eukaryotic translation initiation factor 4E type, putative	0.0048	0.0176	0.0672
Echinococcus multilocularis	hypoxanthine guanine phosphoribosyltransferase	0.0092	0.0473	0.183

Activities

Activity type	Activity value	Assay description	Source	Reference
ED50 (functional)	= 6.5 mg kg-1	In vivo inhibition of brain N-methylhistamine formation in mice when administered perorally in presence of oxalate salt	ChEMBL.	15163206
ED50 (functional)	= 6.5 mg kg-1	In vivo inhibition of brain N-methylhistamine formation in mice when administered perorally in presence of oxalate salt	ChEMBL.	15163206
Intrinsic activity (functional)	= 0	Intrinsic activity was determined inhibition of brain N-mehtylhistamine formation in mice relative to imetit	ChEMBL.	15163206
Ki (binding)	= 38 nM	In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes	ChEMBL.	15163206
Ki (binding)	= 38 nM	In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes	ChEMBL.	15163206

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: CHEMBL109498
PubChem: 11149841

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 183560