TDR Targets

Basic information

Technical information

TDR Targets ID: 595559
Name: 4-[(4-diethylaminophenyl)-(4-nitrophenyl)meth yl]-N,N-diethylaniline
MW: 431.57 | Formula: C27H33N3O2
H donors: 0 H acceptors: 2 LogP: 6.84 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCN(c1ccc(cc1)C(c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)N(CC)CC)CC
InChi: 1S/C27H33N3O2/c1-5-28(6-2)24-15-9-21(10-16-24)27(23-13-19-26(20-14-23)30(31)32)22-11-17-25(18-12-22)29(7-3)8-4/h9-20,27H,5-8H2,1-4H3
InChiKey: VMQGVVBBBYRPKU-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-diethylaminophenyl)-(4-nitrophenyl)methyl]-N,N-diethyl-aniline
[4-[(4-diethylaminophenyl)-(4-nitrophenyl)methyl]phenyl]-diethyl-amine

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Schistosoma mansoni	survival motor neuron protein	0.0063	0.0222	0.0281
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0067	0.0239	0.0303
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0119	0.0446	0.0564
Brugia malayi	Glutamate receptor 1 precursor	0.0014	0.0027	0.0035
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Brugia malayi	hypothetical protein	0.0011	0.0015	0.0018
Entamoeba histolytica	hypothetical protein	0.0019	0.0046	0.1923
Onchocerca volvulus		0.1379	0.5489	1
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0043	0.0143	0.0143
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Echinococcus granulosus	glutamate receptor 2	0.0021	0.0056	0.0071
Echinococcus granulosus	tar DNA binding protein	0.0037	0.0121	0.0153
Brugia malayi	hypothetical protein	0.0013	0.0025	0.0032
Entamoeba histolytica	transcription factor BTF3, putative	0.0019	0.0046	0.1923
Leishmania major	basic transcription factor 3a, putative	0.0019	0.0046	0.0046
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.001	0.0011	0.0015
Brugia malayi	MH1 domain containing protein	0.001	0.0011	0.0015
Brugia malayi	Niemann-Pick C1 protein precursor	0.0053	0.0182	0.023
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.2506	1	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0109	0.0406	0.0514
Onchocerca volvulus		0.0063	0.0222	0.0404
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0109	0.0406	0.0514
Schistosoma mansoni	neurotransmitter gated ion channel	0.0042	0.0138	0.0175
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0109	0.0406	0.0514
Mycobacterium ulcerans	thymidylate synthase	0.1379	0.5489	0.6902
Loa Loa (eye worm)	MH2 domain-containing protein	0.001	0.0011	0.0015
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.1982	0.7901	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0023	0.0064	0.0081
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0119	0.0446	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0307	0.1199	0.1518
Brugia malayi	TAR-binding protein	0.0037	0.0121	0.0153
Schistosoma mansoni	tar DNA-binding protein	0.0037	0.0121	0.0153
Brugia malayi	MH1 domain containing protein	0.001	0.0011	0.0015
Echinococcus multilocularis	glutamate receptor ionotropic kainate	0.0014	0.0027	0.0035
Echinococcus granulosus	GPCR family 2	0.0023	0.0064	0.0081
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.1263	0.5026	0.6361
Schistosoma mansoni	glutamate receptor AMPA	0.0014	0.0027	0.0035
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0043	0.0143	0.018
Echinococcus granulosus	glutamate receptor ionotrophic AMPA 3	0.0021	0.0056	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0025	0.0032
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 3	0.005	0.0171	0.0217
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0062	0.0078
Loa Loa (eye worm)	aryl Hydrocarbon receptor Associated protein family member	0.0011	0.0015	0.0018
Onchocerca volvulus		0.0109	0.0406	0.074
Loa Loa (eye worm)	acetylcholine receptor protein	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Schistosoma mansoni	tar DNA-binding protein	0.0037	0.0121	0.0153
Entamoeba histolytica	hypothetical protein	0.0059	0.0206	0.8616
Echinococcus multilocularis	protein patched	0.0023	0.0062	0.0078
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	dihydrofolate reductase	0.1982	0.7901	1
Schistosoma mansoni	hypothetical protein	0.0022	0.0058	0.0074
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Schistosoma mansoni	cpg binding protein	0.0029	0.0089	0.0112
Schistosoma mansoni	hypothetical protein	0.0063	0.0222	0.0281
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0042	0.0138	0.0175
Schistosoma mansoni	smad1 5 8 and	0.001	0.0011	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0002	0.0002
Schistosoma mansoni	tar DNA-binding protein	0.0037	0.0121	0.0153
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0067	0.0239	0.0303
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0067	0.0239	0.0303
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0042	0.0138	0.0175
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0109	0.0406	0.0514
Brugia malayi	beta-NAC-like protein	0.0019	0.0046	0.0058
Trypanosoma cruzi	transcription factor btf3, putative	0.0019	0.0046	0.0046
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Echinococcus multilocularis	nmda type glutamate receptor	0.005	0.0171	0.0217
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0119	0.0446	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0109	0.0406	0.0514
Echinococcus multilocularis	NMDA receptor	0.0014	0.0027	0.0035
Brugia malayi	latrophilin 2 splice variant baaae	0.005	0.0172	0.0217
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0043	0.0143	0.0143
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Onchocerca volvulus		0.0011	0.0015	0.0026
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Chlamydia trachomatis	dihydrofolate reductase	0.1982	0.7901	1
Brugia malayi	aryl hydrocarbon receptor nuclear translocator protein, putative	0.0008	0.0002	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Echinococcus multilocularis	glycine receptor subunit beta	0.0109	0.0406	0.0514
Loa Loa (eye worm)	MH1 domain-containing protein	0.001	0.0011	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0265	0.0335
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.001	0.0011	0.0015
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	glutamate receptor kainate	0.0014	0.0027	0.0035
Entamoeba histolytica	hypothetical protein	0.0059	0.0206	0.8616
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0109	0.0406	0.0514
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0053	0.0182	0.7599
Echinococcus granulosus	glycine receptor subunit beta	0.0109	0.0406	0.0514
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0023	0.0064	0.0081
Brugia malayi	Cation transporter family protein	0.0109	0.0406	0.0514
Echinococcus granulosus	mothers against decapentaplegic 5	0.001	0.0011	0.0015
Brugia malayi	Isocitrate dehydrogenase	0.0043	0.0143	0.018
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0109	0.0406	0.0514
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0021	0.0056	0.0071
Loa Loa (eye worm)	ACC-1 protein	0.0109	0.0406	0.0514
Onchocerca volvulus		0.0042	0.0138	0.0252
Brugia malayi	MH2 domain containing protein	0.001	0.0011	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus granulosus	sterol regulatory element binding protein	0.0023	0.0062	0.0078
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0083	0.0303	0.0551
Echinococcus granulosus	nAChR subunit	0.0067	0.0239	0.0303
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0021	0.0056	0.0071
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0067	0.0239	0.0303
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0447	0.1759	0.1738
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0006	0.0007
Brugia malayi	hypothetical protein	0.0656	0.2596	0.3286
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0067	0.0239	0.0303
Schistosoma mansoni	glutamate receptor NMDA	0.0021	0.0056	0.0071
Schistosoma mansoni	hypothetical protein	0.0023	0.0064	0.0081
Echinococcus multilocularis	isocitrate dehydrogenase	0.0043	0.0143	0.018
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0109	0.0406	0.0514
Brugia malayi	RNA binding protein	0.0037	0.0121	0.0153
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0021	0.0056	0.0071
Onchocerca volvulus		0.0109	0.0406	0.074
Onchocerca volvulus	Glucosylceramidase homolog	0.0164	0.0627	0.1143
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0059	0.0206	0.0261
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0043	0.0143	0.018
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Echinococcus granulosus	aryl hydrocarbon receptor	0.0011	0.0015	0.0018
Echinococcus multilocularis	glutamate receptor, ionotrophic, AMPA 3	0.0021	0.0056	0.0071
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.025	0.0971	0.1229
Leishmania major	hypothetical protein, conserved	0.0013	0.0025	0.0025
Onchocerca volvulus		0.0042	0.0138	0.0252
Brugia malayi	N-terminal motif family protein	0.0083	0.0303	0.0383
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.1379	0.5489	0.6947
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0042	0.0138	0.0175
Echinococcus multilocularis	mothers against decapentaplegic 5	0.001	0.0011	0.0015
Plasmodium falciparum	basic transcription factor 3b, putative	0.0019	0.0046	0.0021
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0119	0.0446	0.0564
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0043	0.0143	0.0143
Loa Loa (eye worm)	RNA binding protein	0.0037	0.0121	0.0153
Onchocerca volvulus		0.0109	0.0406	0.074
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0063	0.0222	0.0281
Loa Loa (eye worm)	dihydrofolate reductase	0.1982	0.7901	1
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Onchocerca volvulus	Putative nachr subunit	0.0109	0.0406	0.074
Schistosoma mansoni	neurotransmitter gated ion channel	0.0067	0.0239	0.0303
Loa Loa (eye worm)	thymidylate synthase	0.1379	0.5489	0.6947
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.2506	1	1
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0002	0.0002
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0053	0.0185	0.0234
Echinococcus multilocularis	glutamate (NMDA) receptor subunit	0.0014	0.0027	0.0035
Schistosoma mansoni	hypothetical protein	0.0022	0.0058	0.0074
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0037	0.0121	0.0153
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0042	0.0138	0.0175
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0109	0.0406	0.0514
Schistosoma mansoni	aryl hydrocarbon receptor nuclear translocator homolog (darnt)	0.0008	0.0002	0.0002
Schistosoma mansoni	glutamate receptor AMPA	0.0014	0.0027	0.0035
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0043	0.0143	0.018
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0021	0.0056	0.0071
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0082	0.0104
Onchocerca volvulus		0.0109	0.0406	0.074
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	GABA receptor subunit	0.0067	0.0239	0.0303
Echinococcus multilocularis	glycine receptor subunit beta	0.0109	0.0406	0.0514
Brugia malayi	Helix-loop-helix DNA-binding domain containing protein	0.0008	0.0002	0.0002
Echinococcus granulosus	glutamate receptor subunit protein glur	0.0014	0.0027	0.0035
Toxoplasma gondii	isocitrate dehydrogenase	0.0043	0.0143	0.0118
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0109	0.0406	0.0514
Brugia malayi	MH2 domain containing protein	0.0148	0.0562	0.0711
Schistosoma mansoni	hypothetical protein	0.0059	0.0206	0.0261
Loa Loa (eye worm)	LGC-31 protein	0.0109	0.0406	0.0514
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0119	0.0446	0.0564
Echinococcus multilocularis	cpg binding protein	0.0029	0.0089	0.0112
Schistosoma mansoni	hypothetical protein	0.0023	0.0064	0.0081
Brugia malayi	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0043	0.0143	0.018
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0109	0.0406	0.0514
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0021	0.0056	0.0071
Trichomonas vaginalis	conserved hypothetical protein	0.0023	0.0062	0.0061
Schistosoma mansoni	tar DNA-binding protein	0.0037	0.0121	0.0153
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0109	0.0406	0.0514
Echinococcus granulosus	expressed conserved protein	0.0049	0.0169	0.0214
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.025	0.0971	0.1229
Loa Loa (eye worm)	glutamate receptor 2	0.0014	0.0027	0.0035
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0109	0.0406	0.0514
Brugia malayi	CHE-14 protein	0.0023	0.0062	0.0078
Echinococcus granulosus	TGF beta signal transducer SmadC	0.001	0.0011	0.0015
Echinococcus multilocularis	tar DNA binding protein	0.0037	0.0121	0.0153
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0109	0.0406	0.0514
Brugia malayi	hypothetical protein	0.0307	0.1199	0.1518
Schistosoma mansoni	hypothetical protein	0.0022	0.0058	0.0074
Echinococcus multilocularis	transcription factor btf3	0.0019	0.0046	0.0058
Echinococcus multilocularis	expressed conserved protein	0.0049	0.0169	0.0214
Echinococcus multilocularis	survival motor neuron protein 1	0.0307	0.1199	0.1518
Echinococcus multilocularis	nAChR subunit	0.0067	0.0239	0.0303
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0109	0.0406	0.0514
Schistosoma mansoni	cpg binding protein	0.0028	0.0082	0.0104
Loa Loa (eye worm)	hypothetical protein	0.005	0.0172	0.0217
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0082	0.0104
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Schistosoma mansoni	transcription factor btf3	0.0019	0.0046	0.0058
Brugia malayi	isocitrate dehydrogenase	0.0043	0.0143	0.018
Brugia malayi	Cation transporter family protein	0.0109	0.0406	0.0514
Trypanosoma cruzi	transcription factor btf3, putative	0.0019	0.0046	0.0046
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Brugia malayi	dihydrofolate reductase family protein	0.1982	0.7901	1
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Brugia malayi	hypothetical protein	0.0059	0.0206	0.0261
Echinococcus multilocularis	glutamate receptor subunit protein glur	0.0014	0.0027	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Brugia malayi	F/Y-rich N-terminus family protein	0.0008	0.0005	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	smad	0.001	0.0011	0.0015
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0042	0.0138	0.0175
Echinococcus multilocularis	Ribosomal protein S1, RNA binding domain	0.0014	0.0027	0.0035
Echinococcus granulosus	dihydrofolate reductase	0.1982	0.7901	1
Brugia malayi	hypothetical protein	0.0009	0.0006	0.0008
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.1379	0.5489	0.6902
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0059	0.0207	0.0262
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0023	0.0064	0.0081
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0042	0.0138	0.0175
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0228	0.0885	0.112
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0043	0.0143	0.0118
Schistosoma mansoni	hypothetical protein	0.0023	0.0064	0.0081
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0109	0.0406	0.0514
Trypanosoma cruzi	PAB1-binding protein , putative	0.0013	0.0025	0.0025
Loa Loa (eye worm)	Smad1	0.001	0.0011	0.0015
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0059	0.0206	0.0261
Loa Loa (eye worm)	transcription factor SMAD2	0.0148	0.0562	0.0711
Schistosoma mansoni	glutamate receptor kainate	0.0014	0.0027	0.0035
Brugia malayi	Dihydrofolate reductase	0.1982	0.7901	1
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Onchocerca volvulus		0.0109	0.0406	0.074
Schistosoma mansoni	hypothetical protein	0.0023	0.0064	0.0081
Echinococcus multilocularis	glutamate receptor 2	0.0021	0.0056	0.0071
Mycobacterium tuberculosis	Hypothetical protein	0.0656	0.2596	0.3187
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0021	0.0056	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0182	0.023
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.0627	0.228
Entamoeba histolytica	hypothetical protein	0.0059	0.0206	0.8616
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Brugia malayi	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0023	0.0064	0.0081
Leishmania major	C-8 sterol isomerase-like protein	0.0447	0.1759	0.1759
Echinococcus granulosus	Ribosomal protein S1 RNA binding domain	0.0014	0.0027	0.0035
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0109	0.0406	0.0514
Echinococcus granulosus	transcription factor btf3	0.0019	0.0046	0.0058
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0023	0.0064	0.0081
Echinococcus multilocularis	protein dispatched 1	0.0026	0.0074	0.0094
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.0663	0.2418
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0015	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Brugia malayi	hypothetical protein	0.0008	0.0002	0.0002
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0042	0.0138	0.0175
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0119	0.0446	0.0564
Schistosoma mansoni	glutamate receptor NMDA	0.0014	0.0027	0.0035
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.0971	0.3628
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0042	0.0138	0.0175
Echinococcus granulosus	nAChR subunit	0.0109	0.0406	0.0514
Schistosoma mansoni	smad1 5 8 and	0.001	0.0011	0.0015
Schistosoma mansoni	smad1 5 8 and	0.001	0.0011	0.0015
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0109	0.0406	0.0514
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein (hisJ)	0.0036	0.0115	0.5
Loa Loa (eye worm)	glutamate receptor 1	0.0014	0.0027	0.0035
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0043	0.0143	0.018
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.2506	1	1
Schistosoma mansoni	transcription factor LCR-F1	0.0059	0.0206	0.0261
Loa Loa (eye worm)	ICD-1 protein	0.0019	0.0046	0.0058
Echinococcus granulosus	survival motor neuron protein 1	0.0307	0.1199	0.1518
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0043	0.0143	0.0118
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Echinococcus granulosus	Niemann Pick C1 protein	0.0053	0.0182	0.023
Brugia malayi	Smad1	0.001	0.0011	0.0015
Echinococcus multilocularis	dnaJ subfamily B	0.0396	0.1555	0.1968
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0109	0.0406	0.0514
Schistosoma mansoni	tar DNA-binding protein	0.0037	0.0121	0.0153
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0064	0.0081
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	Smad4	0.001	0.0011	0.0015
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Echinococcus granulosus	smad	0.001	0.0011	0.0015
Echinococcus granulosus	geminin	0.0073	0.0265	0.0335
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Brugia malayi	Glutamate receptor 2 precursor	0.0014	0.0027	0.0035
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0109	0.0406	0.0514
Brugia malayi	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus granulosus	glutamate NMDA receptor subunit	0.0014	0.0027	0.0035
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0042	0.0138	0.0175
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Echinococcus granulosus	Niemann Pick C1 protein	0.0075	0.0272	0.0345
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0119	0.0446	0.0564
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0023	0.0062	0.0078
Echinococcus multilocularis	sterol regulatory element binding protein	0.0023	0.0062	0.0078
Echinococcus granulosus	glycine receptor subunit beta	0.0109	0.0406	0.0514
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0109	0.0406	0.0514
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0109	0.0406	0.0514
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0006	0.0007
Brugia malayi	hypothetical protein	0.0042	0.0138	0.0175
Echinococcus granulosus	Smad4	0.001	0.0011	0.0015
Schistosoma mansoni	nAChR subunit	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0002	0.0002
Brugia malayi	Cation transporter family protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Echinococcus multilocularis	glutamate receptor 2	0.0014	0.0027	0.0035
Echinococcus multilocularis	smad	0.001	0.0011	0.0015
Echinococcus granulosus	nmda type glutamate receptor	0.005	0.0171	0.0217
Onchocerca volvulus		0.0109	0.0406	0.074
Echinococcus multilocularis	thymidylate synthase	0.1379	0.5489	0.6947
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.1982	0.7901	1
Trichomonas vaginalis	conserved hypothetical protein	0.0656	0.2596	1
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0067	0.0239	0.0303
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Echinococcus granulosus	cpg binding protein	0.0029	0.0089	0.0112
Echinococcus granulosus	glutamate receptor ionotropic kainate	0.0014	0.0027	0.0035
Entamoeba histolytica	hypothetical protein	0.0067	0.0239	1
Onchocerca volvulus		0.0028	0.0082	0.015
Echinococcus multilocularis	dihydrofolate reductase	0.1982	0.7901	1
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.0663	0.2418
Onchocerca volvulus		0.0067	0.0239	0.0436
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0109	0.0406	0.0514
Schistosoma mansoni	hypothetical protein	0.005	0.0172	0.0217
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.1982	0.7901	1
Onchocerca volvulus		0.0067	0.0239	0.0436
Schistosoma mansoni	glutamate receptor kainate	0.0014	0.0027	0.0035
Schistosoma mansoni	hypothetical protein	0.0073	0.0265	0.0335
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0073	0.0265	0.0335
Onchocerca volvulus		0.0042	0.0138	0.0252
Brugia malayi	excitatory GABA receptor EXP-1A	0.0109	0.0406	0.0514
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0109	0.0406	0.0514
Brugia malayi	hypothetical protein	0.0008	0.0002	0.0002
Trypanosoma cruzi	PAB1-binding protein , putative	0.0013	0.0025	0.0025
Echinococcus multilocularis	geminin	0.0073	0.0265	0.0335
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.2506	1	1
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0109	0.0406	0.0514
Echinococcus multilocularis	GPCR, family 2	0.0023	0.0064	0.0081
Toxoplasma gondii	NAC domain-containing protein	0.0019	0.0046	0.0021
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0303	0.0383
Schistosoma mansoni	hypothetical protein	0.0073	0.0265	0.0335
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0119	0.0446	0.0564
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0043	0.0143	0.018
Brugia malayi	MH2 domain containing protein	0.001	0.0011	0.0015
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.0182	0.0157
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0109	0.0406	0.0514
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0447	0.1759	0.2226
Schistosoma mansoni	hypothetical protein	0.0396	0.1555	0.1968
Schistosoma mansoni	hypothetical protein	0.0022	0.0058	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Schistosoma mansoni	patched 1	0.0023	0.0062	0.0078
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0109	0.0406	0.0514
Loa Loa (eye worm)	MH2 domain-containing protein	0.0148	0.0562	0.0711
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0109	0.0406	0.0514
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0109	0.0406	0.0514
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0447	0.1759	0.2226
Brugia malayi	RNA recognition motif domain containing protein	0.0037	0.0121	0.0153
Echinococcus granulosus	Protein patched homolog 1	0.0023	0.0062	0.0078
Brugia malayi	aryl hydrocarbon receptor AHR-1	0.0008	0.0002	0.0002
Schistosoma mansoni	nAChR subunit	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	TAR-binding protein	0.0037	0.0121	0.0153
Echinococcus multilocularis	Niemann Pick C1 protein	0.0075	0.0272	0.0345
Onchocerca volvulus	Protein cycle homolog	0.0008	0.0002	0.0003
Loa Loa (eye worm)	helix-loop-helix DNA-binding domain-containing protein	0.0008	0.0002	0.0002
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0406	0.0514
Echinococcus granulosus	glutamate receptor ionotropic kainate 3	0.0014	0.0027	0.0035
Trypanosoma brucei	transcription factor BTF3, putative	0.0019	0.0046	0.0021
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0119	0.0446	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Schistosoma mansoni	neurotransmitter gated ion channel	0.0042	0.0138	0.0175
Echinococcus multilocularis	Niemann Pick C1 protein	0.0053	0.0182	0.023
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein	0.0036	0.0115	0.5
Schistosoma mansoni	ATP-binding cassette transporter	0.0014	0.0027	0.0035
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase, putative	0.0656	0.2596	0.2596
Brugia malayi	hypothetical protein	0.0042	0.0138	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0073	0.0265	0.0335
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0073	0.0265	0.0335
Echinococcus granulosus	dnaJ subfamily B	0.0396	0.1555	0.1968
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0042	0.0138	0.0175
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Schistosoma mansoni	cpg binding protein	0.0029	0.0089	0.0112
Schistosoma mansoni	nAChR subunit	0.0109	0.0406	0.0514
Toxoplasma gondii	isocitrate dehydrogenase	0.0043	0.0143	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0138	0.0175
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0109	0.0406	0.0514
Echinococcus multilocularis	aryl hydrocarbon receptor	0.0011	0.0015	0.0018
Plasmodium vivax	basic transcription factor 3b, putative	0.0019	0.0046	0.0021
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.2506	1	1
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0043	0.0143	0.0035
Loa Loa (eye worm)	ACC-1 protein	0.0109	0.0406	0.0514
Brugia malayi	Latrophilin receptor protein 2	0.0023	0.0064	0.0081
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0043	0.0143	0.0118
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0082	0.0104
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0043	0.0143	0.018
Echinococcus granulosus	thymidylate synthase	0.1379	0.5489	0.6947
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0006	0.0007
Echinococcus multilocularis	nAChR subunit	0.0109	0.0406	0.0514
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0447	0.1759	0.1759
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0109	0.0406	0.0514
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0109	0.0406	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0239	0.0303
Brugia malayi	thymidylate synthase	0.1379	0.5489	0.6947
Schistosoma mansoni	acetylcholine receptor-related	0.0042	0.0138	0.0175
Echinococcus multilocularis	Smad4	0.001	0.0011	0.0015
Schistosoma mansoni	hypothetical protein	0.0014	0.0027	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0008	0.0002	0.0002
Entamoeba histolytica	hypothetical protein	0.0059	0.0206	0.8616
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0043	0.0143	0.0118
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0023	0.0064	0.0081
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0042	0.0138	0.0175

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 0 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 8.28 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 10.44 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 15.32 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 20 %	GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM.	ChEMBL.	20485427
Inhibition (functional)	= 63 %	GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 82 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition frequency index (IFI) (functional)	= 4.35	Inhibition Frequency Index (IFI)	GSK.	20485427
Percent growth inhibition (functional)	= 0 %	Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 20 %	Percent inhibition of HepG2 growth (at 10 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 63 %	Percent inhibition of P. falciparum Dd2 growth (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 82 %	Percent inhibition of P. falciparum 3D7 growth (at 2 uM)	GSK.	20485427
XC50 (functional)	= 6.02	XC50 determination of P. falciparum 3D7 growth	GSK.	20485427
XC50 (functional)	= 0.94647 uM	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth.	ChEMBL.	20485427

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: CHEMBL547609
Search by GSK

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 595559