TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 493.663 | Formula: C28H40FN7
H donors: 3 H acceptors: 3 LogP: 7.06 Rotable bonds: 12
Rule of 5 violations (Lipinski): 1
SMILES: C=CCNc1nc(nc(n1)NCC=C)N1CCC(CC1)NCC(c1ccc(cc1)F)C1CCCCC1
InChi: 1S/C28H40FN7/c1-3-16-30-26-33-27(31-17-4-2)35-28(34-26)36-18-14-24(15-19-36)32-20-25(21-8-6-5-7-9-21)22-10-12-23(29)13-11-22/h3-4,10-13,21,24-25,32H,1-2,5-9,14-20H2,(H2,30,31,33,34,35)
InChiKey: XBYPJJQIYFPUCD-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

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
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0009	0.0029	0.0045
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0031	0.0031
Loa Loa (eye worm)	intermediate filament protein	0.0023	0.0276	0.0433
Onchocerca volvulus		0.0024	0.0302	0.043
Loa Loa (eye worm)	hypothetical protein	0.0127	0.2071	0.3249
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0013	0.0112	0.0112
Loa Loa (eye worm)	hypothetical protein	0.0254	0.4267	0.6693
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0009	0.0029	0.0045
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.003	0.0047
Brugia malayi	Intermediate filament tail domain containing protein	0.0023	0.0276	0.0433
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0009	0.0029	0.0045
Schistosoma mansoni	microtubule-associated protein tau	0.0586	1	1
Loa Loa (eye worm)	steroid hormone receptor	0.0009	0.0029	0.0045
Echinococcus granulosus	survival motor neuron protein 1	0.0254	0.4267	0.4267
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0024	0.0302	0.0473
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0064	0.0101
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0013	0.0112	0.0112
Brugia malayi	isocitrate dehydrogenase	0.0013	0.0112	0.0176
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Echinococcus granulosus	lamin dm0	0.0023	0.0276	0.0276
Loa Loa (eye worm)	hypothetical protein	0.0125	0.2035	0.3192
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0009	0.0029	0.0029
Loa Loa (eye worm)	TATA binding protein associated factor	0.0012	0.0089	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0186	0.3093	0.4852
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0072	0.0112
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0009	0.0029	0.0045
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0013	0.0112	0.0112
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0052	0.0771	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0052	0.0771	1
Echinococcus multilocularis	lamin	0.0023	0.0276	0.0276
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0009	0.0029	0.0045
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Toxoplasma gondii	isocitrate dehydrogenase	0.0013	0.0112	0.0348
Schistosoma mansoni	hypothetical protein	0.0039	0.0548	0.0548
Schistosoma mansoni	hypothetical protein	0.0052	0.0775	0.0775
Brugia malayi	hypothetical protein	0.0039	0.0548	0.086
Loa Loa (eye worm)	hypothetical protein	0.0127	0.2071	0.3249
Echinococcus multilocularis	isocitrate dehydrogenase	0.0013	0.0112	0.0112
Brugia malayi	intermediate filament protein	0.0023	0.0276	0.0433
Echinococcus granulosus	biogenic amine 5HT receptor	0.0125	0.2035	0.2035
Echinococcus multilocularis	muscleblind protein	0.0127	0.2071	0.2071
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0023	0.0276	0.0433
Brugia malayi	CXXC zinc finger family protein	0.0024	0.0302	0.0473
Echinococcus granulosus	FTZ F1 alpha	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0039	0.0548	0.0548
Brugia malayi	Pre-SET motif family protein	0.0033	0.0444	0.0696
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0052	0.0771	0.0771
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Brugia malayi	TATA binding protein associated factor	0.0012	0.0089	0.0139
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0013	0.0112	0.0112
Brugia malayi	hypothetical protein	0.0376	0.6376	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0009	0.0029	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0089	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0089	0.0139
Echinococcus granulosus	aminopeptidase N	0.0012	0.0089	0.0089
Schistosoma mansoni	hypothetical protein	0.0348	0.5879	0.5879
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0009	0.0029	0.0045
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0052	0.0775	0.1216
Schistosoma mansoni	retinoic acid receptor RXR	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0376	0.6376	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0009	0.0029	0.0045
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0013	0.0112	0.0039
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0056	0.0849	0.1251
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0009	0.0029	0.0029
Loa Loa (eye worm)	leukotriene A4 hydrolase	0.0227	0.3794	0.5951
Schistosoma mansoni	thyroid hormone receptor	0.0009	0.0029	0.0029
Brugia malayi	hypothetical protein	0.0012	0.0089	0.0139
Onchocerca volvulus		0.0012	0.0089	0.0094
Schistosoma mansoni	lozenge	0.0047	0.0695	0.0695
Brugia malayi	nuclear receptor NHR-88	0.0009	0.0029	0.0045
Echinococcus multilocularis	muscleblind protein 1	0.0127	0.2071	0.2071
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0364	0.6167	1
Onchocerca volvulus		0.0012	0.0089	0.0094
Onchocerca volvulus		0.0012	0.0089	0.0094
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0006	0.0006
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0444	0.0444
Echinococcus granulosus	lamin	0.0023	0.0276	0.0276
Onchocerca volvulus		0.0033	0.0444	0.0653
Echinococcus multilocularis	aminopeptidase N	0.0012	0.0089	0.0089
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0009	0.0029	0.0045
Schistosoma mansoni	aldehyde dehydrogenase	0.0052	0.0771	0.0771
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0013	0.0112	0.0039
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0047	0.0699	0.8943
Loa Loa (eye worm)	peptidase family M1 containing protein	0.0012	0.0089	0.0139
Schistosoma mansoni	transcription factor LCR-F1	0.0039	0.0548	0.0548
Echinococcus granulosus	cpg binding protein	0.0026	0.0326	0.0326
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0009	0.0029	0.0029
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0009	0.0029	0.0045
Brugia malayi	hypothetical protein	0.0104	0.168	0.2635
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0013	0.0112	0.0039
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0033	0.0444	0.5202
Loa Loa (eye worm)	hypothetical protein	0.0125	0.2035	0.3192
Schistosoma mansoni	RAR-like nuclear receptor	0.0009	0.0029	0.0029
Schistosoma mansoni	nuclear hormone receptor	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0376	0.6376	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0009	0.0029	0.0045
Echinococcus granulosus	histone lysine methyltransferase setb	0.0033	0.0444	0.0444
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0006	0.0006
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0039	0.0548	0.0548
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0444	0.0444
Loa Loa (eye worm)	hypothetical protein	0.0104	0.1677	0.2631
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0052	0.0771	0.1123
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0006	0.0006
Echinococcus multilocularis	lamin dm0	0.0023	0.0276	0.0276
Brugia malayi	Muscleblind-like protein	0.0127	0.2071	0.3249
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0056	0.0849	0.0849
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0009	0.0029	0.0045
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0056	0.0849	0.0849
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0006	0.0006
Echinococcus multilocularis	musashi	0.0023	0.0276	0.0276
Brugia malayi	MH2 domain containing protein	0.0101	0.1631	0.2559
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0009	0.0029	0.0029
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0224	0.375	0.5882
Schistosoma mansoni	survival motor neuron protein	0.0052	0.0775	0.0775
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0064	0.0101
Echinococcus multilocularis	Protein lozenge	0.0047	0.0695	0.0695
Leishmania major	C-8 sterol isomerase-like protein	0.0364	0.6167	1
Entamoeba histolytica	hypothetical protein	0.0039	0.0548	0.6045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0009	0.0029	0.0045
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.0012	0.0089	0.0089
Schistosoma mansoni	thyroid hormone receptor	0.0009	0.0029	0.0029
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0056	0.0849	0.1331
Brugia malayi	Peptidase family M1 containing protein	0.0012	0.0089	0.0139
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0012	0.0089	0.0089
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0056	0.0849	0.1251
Echinococcus granulosus	leukotriene A 4 hydrolase	0.0227	0.3794	0.3794
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0364	0.6167	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0009	0.0029	0.0029
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0444	0.0444
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0089	0.0139
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0009	0.0029	0.0045
Echinococcus granulosus	transcription factor Dp 1	0.0032	0.0441	0.0441
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0011	0.0072	0.0072
Onchocerca volvulus		0.0255	0.4284	0.6704
Brugia malayi	Isocitrate dehydrogenase	0.0013	0.0112	0.0176
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0009	0.0029	0.0029
Brugia malayi	hypothetical protein	0.0012	0.0089	0.0139
Echinococcus multilocularis	serotonin receptor	0.0125	0.2035	0.2035
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Onchocerca volvulus		0.0023	0.0276	0.039
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0009	0.0029	0.0029
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0125	0.2035	0.2035
Loa Loa (eye worm)	transcription factor SMAD2	0.0101	0.1631	0.2559
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0276	0.0433
Schistosoma mansoni	intermediate filament proteins	0.0023	0.0276	0.0276
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0052	0.0771	1
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0033	0.0444	0.0444
Echinococcus multilocularis	transcription factor Dp 1	0.0032	0.0441	0.0441
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0009	0.0029	0.0045
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0013	0.0112	0.0176
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0013	0.0112	0.067
Echinococcus granulosus	ecdysone induced protein 78C	0.0009	0.0029	0.0029
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0052	0.0771	0.0771
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0009	0.0029	0.0045
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0009	0.0029	0.0029
Echinococcus granulosus	intermediate filament protein	0.0023	0.0276	0.0276
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.0012	0.0089	0.0089
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0053	0.0794	0.0794
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0013	0.0112	0.0039
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0013	0.0112	0.0112
Brugia malayi	hypothetical protein	0.0254	0.4267	0.6693
Onchocerca volvulus		0.0376	0.6376	1
Brugia malayi	Peptidase family M1 containing protein	0.0012	0.0089	0.0139
Echinococcus multilocularis	dnaJ subfamily B	0.0348	0.5879	0.5879
Loa Loa (eye worm)	hypothetical protein	0.0104	0.1677	0.2631
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0009	0.0029	0.0045
Echinococcus multilocularis	ecdysone induced protein 78C	0.0009	0.0029	0.0029
Brugia malayi	nuclear hormone receptor	0.0009	0.0029	0.0045
Schistosoma mansoni	cpg binding protein	0.0026	0.0326	0.0326
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0056	0.0849	0.0849
Schistosoma mansoni	aminopeptidase A (M01 family)	0.0012	0.0089	0.0089
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0009	0.0029	0.0045
Onchocerca volvulus		0.0052	0.0775	0.1176
Onchocerca volvulus	Huntingtin homolog	0.0104	0.1677	0.2597
Trichomonas vaginalis	set domain proteins, putative	0.0255	0.4284	1
Brugia malayi	Peptidase family M1 containing protein	0.0012	0.0089	0.0139
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0012	0.0093	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Entamoeba histolytica	hypothetical protein	0.0039	0.0548	0.6045
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0009	0.0029	0.0029
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0056	0.0849	0.1331
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0009	0.0029	0.0029
Brugia malayi	Pre-SET motif family protein	0.0224	0.375	0.5882
Schistosoma mansoni	cpg binding protein	0.0026	0.0326	0.0326
Brugia malayi	Nuclear hormone receptor-like 1	0.0009	0.0029	0.0045
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0009	0.0029	0.0029
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0009	0.0029	0.0029
Echinococcus granulosus	muscleblind protein	0.0127	0.2071	0.2071
Brugia malayi	Steroid receptor seven-up type 2	0.0009	0.0029	0.0045
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0006	0.0006
Schistosoma mansoni	lamin	0.0023	0.0276	0.0276
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0033	0.0444	0.0444
Onchocerca volvulus		0.0023	0.0276	0.039
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0009	0.0029	0.0029
Echinococcus multilocularis	cpg binding protein	0.0026	0.0326	0.0326
Toxoplasma gondii	isocitrate dehydrogenase	0.0013	0.0112	0.0348
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0009	0.0029	0.0029
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0414	0.0414
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0056	0.0849	1
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0056	0.0849	0.1251
Loa Loa (eye worm)	aminopeptidase N	0.0012	0.0089	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0269	0.0422
Entamoeba histolytica	hypothetical protein	0.0039	0.0548	0.6045
Loa Loa (eye worm)	hypothetical protein	0.0364	0.6167	0.9672
Onchocerca volvulus	Huntingtin homolog	0.0104	0.1677	0.2597
Plasmodium vivax	SET domain protein, putative	0.0033	0.0444	1
Loa Loa (eye worm)	runx1	0.0047	0.0695	0.1091
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0009	0.0029	0.0029
Brugia malayi	hypothetical protein	0.0104	0.1677	0.2631
Schistosoma mansoni	aldehyde dehydrogenase	0.0052	0.0771	0.0771
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0009	0.0029	0.0045
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0009	0.0029	0.0029
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0011	0.0072	0.0072
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0013	0.0112	0.0112
Brugia malayi	ecdysteroid receptor	0.0009	0.0029	0.0045
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0033	0.0444	0.0444
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0364	0.6167	0.9672
Schistosoma mansoni	Tata binding protein associated factor (M01 family)	0.0012	0.0089	0.0089
Brugia malayi	cytoplasmic intermediate filament protein	0.0012	0.0093	0.0145
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0009	0.0029	0.0045
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0031	0.0049
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0012	0.0089	0.0089
Schistosoma mansoni	coup transcription factor	0.0009	0.0029	0.0029
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0009	0.0029	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0029	0.0045
Echinococcus multilocularis	leukotriene A 4 hydrolase	0.0227	0.3794	0.3794
Echinococcus multilocularis	serotonin receptor	0.0125	0.2035	0.2035
Toxoplasma gondii	aldehyde dehydrogenase	0.0052	0.0771	1
Schistosoma mansoni	leukotriene A4 hydrolase (M01 family)	0.0227	0.3794	0.3794
Schistosoma mansoni	lamin	0.0023	0.0276	0.0276
Schistosoma mansoni	cpg binding protein	0.0024	0.0302	0.0302
Echinococcus granulosus	dnaJ subfamily B	0.0348	0.5879	0.5879
Echinococcus multilocularis	FTZ F1 alpha	0.0009	0.0029	0.0029
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0013	0.0112	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0009	0.0029	0.0029
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0056	0.0849	0.1251
Echinococcus multilocularis	microtubule associated protein 2	0.0586	1	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0444	0.0696
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0009	0.0029	0.0045
Brugia malayi	steroid hormone receptor	0.0009	0.0029	0.0045
Echinococcus multilocularis	survival motor neuron protein 1	0.0254	0.4267	0.4267
Entamoeba histolytica	hypothetical protein	0.0039	0.0548	0.6045
Loa Loa (eye worm)	MH2 domain-containing protein	0.0101	0.1631	0.2559
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0052	0.0771	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0031	0.0031
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0013	0.0112	0.0039
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0009	0.0029	0.0029

Activities

Activity type	Activity value	Assay description	Source	Reference
Fold reversion (functional)	< 25	In vitro activity in DC-3F/AD cell line Ratio of IC50(adriamycin alone) / IC50(adriamycin + modulator) at a concentration of 10 microM	ChEMBL.	1352353
Fold reversion (functional)	= 142	In vitro activity in KB-A1 cell line activity expressed as fold reversion (Ratio of IC50(adriamycin alone) / IC50(adriamycin + modulator) at a concentration of 5 microM	ChEMBL.	1352353
Fold reversion (functional)	= 1009	In vitro activity in DC-3F/AD cell line(Ratio of IC50(adriamycin alone) / IC50(adriamycin + modulator) at a concentration of 5 microM	ChEMBL.	1352353
Increase (functional)	= 30.1	Increase in adriamycin uptake in modulator-treated cells relative to untreated cells at a concentration of 5 microM	ChEMBL.	1352353
Increase (functional)	= 34.6	Increase in adriamycin uptake in modulator-treated cells relative to untreated cells at a concentration of 10 microM	ChEMBL.	1352353
Increase (functional)	= 48.1	Increase in adriamycin uptake in modulator-treated cells relative to untreated KB-A1 cells at a concentration of 5 microM	ChEMBL.	1352353
Viability (functional)	= 71 %	Percent of cell viability remaining after incubating the cells with the modulator alone	ChEMBL.	1352353
Viability (functional)	= 71 %	Percent of cell viability remaining after incubating the cells with the modulator alone	ChEMBL.	1352353
Viability (functional)	= 85 %	Percent of cell viability remaining after incubating the cells with the modulator alone a concentration of 5 microM	ChEMBL.	1352353

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.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 137417