TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 537.733 | Formula: C32H47N3O4
H donors: 3 H acceptors: 4 LogP: 6.46 Rotable bonds: 23
Rule of 5 violations (Lipinski): 2
SMILES: CCCCCCCC(N(C(=O)CCCCCCC(=O)NO)Cc1ccccc1)C(=O)NCCc1ccccc1
InChi: 1S/C32H47N3O4/c1-2-3-4-5-14-21-29(32(38)33-25-24-27-17-10-8-11-18-27)35(26-28-19-12-9-13-20-28)31(37)23-16-7-6-15-22-30(36)34-39/h8-13,17-20,29,39H,2-7,14-16,21-26H2,1H3,(H,33,38)(H,34,36)
InChiKey: LPNHYJCVJDLTDK-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
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0017	0.0042	0.0066
Plasmodium vivax	ataxin-2 like protein, putative	0.0027	0.0101	0.3995
Echinococcus granulosus	intermediate filament protein	0.0027	0.0098	0.0196
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0021	0.0064	0.07
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0048	0.0025
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0092	0.1221
Schistosoma mansoni	hypothetical protein	0.0044	0.0199	0.0433
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0111	0.467
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0043	0.019	0.0663
Trypanosoma brucei	DNA polymerase eta, putative	0.0014	0.0026	0.0455
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0038	0.0668
Brugia malayi	Protein kinase domain containing protein	0.0097	0.0504	0.148
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0017	0.0042	0.0018
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0114	0.0235
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0075	0.0376	0.0847
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0054	0.0814
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0114	0.0235
Brugia malayi	O-methyltransferase family protein	0.018	0.0987	0.2973
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0017	0.0042	0.0302
Leishmania major	DNA polymerase kappa, putative	0.0021	0.0064	0.07
Loa Loa (eye worm)	hypothetical protein	0.0096	0.0501	0.15
Loa Loa (eye worm)	acetyltransferase	0.0145	0.0784	0.2373
Loa Loa (eye worm)	hypothetical protein	0.0572	0.3258	1
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.0567	1
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.0567	1
Schistosoma mansoni	microtubule-associated protein tau	0.0749	0.4284	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.0153	0.0828	0.1906
Onchocerca volvulus		0.018	0.0987	0.7391
Brugia malayi	hypothetical protein	0.0164	0.0893	0.2684
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0114	0.5857
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0014	0.0026	0.0035
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0092	0.0038
Schistosoma mansoni	6-phosphofructokinase	0.0108	0.0567	0.1295
Echinococcus granulosus	microtubule associated protein 2	0.0749	0.4284	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0038	0.0668
Onchocerca volvulus		0.0234	0.1302	1
Echinococcus multilocularis	isocitrate dehydrogenase	0.0017	0.0042	0.0066
Echinococcus multilocularis	microtubule associated protein 2	0.0749	0.4284	1
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0114	0.0235
Mycobacterium leprae	PROBABLE METHYLTRANSFERASE	0.018	0.0987	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0048	0.0025
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0208	0.0456
Toxoplasma gondii	isocitrate dehydrogenase	0.0017	0.0042	0.1943
Brugia malayi	Pre-SET motif family protein	0.0206	0.1137	0.3439
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0178	0.2822
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0017	0.0042	0.0066
Entamoeba histolytica	acyl-coA synthetase, putative	0.0026	0.0092	0.1221
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0017	0.0042	0.0743
Echinococcus granulosus	Niemann Pick C1 protein	0.0153	0.0828	0.1906
Echinococcus multilocularis	sterol regulatory element binding protein	0.0046	0.0208	0.0456
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0111	0.467
Schistosoma mansoni	o-methyltransferase	0.018	0.0987	0.2278
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0092	0.1221
Echinococcus multilocularis	lamin dm0	0.0027	0.0098	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0056	0.0268	0.0782
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0111	1
Brugia malayi	6-phosphofructokinase	0.0108	0.0567	0.1674
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0014	0.0026	0.0028
Trypanosoma brucei	DNA polymerase IV, putative	0.0034	0.0141	0.248
Brugia malayi	O-methyltransferase family protein	0.018	0.0987	0.2973
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0095	0.0247
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0108	0.0567	1
Onchocerca volvulus		0.018	0.0987	0.7391
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0092	0.0038
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0108	0.0567	0.5307
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0145	0.0784	0.1805
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0107	0.0562	0.9915
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0026	0.0035
Echinococcus granulosus	6 phosphofructokinase	0.0108	0.0567	0.1295
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0048	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0054	0.0122
Brugia malayi	small heat shock protein	0.0572	0.3258	1
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0108	0.0572	0.1306
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.0567	0.3823
Loa Loa (eye worm)	phosphofructokinase	0.0108	0.0567	0.1702
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0043	0.019	0.0663
Echinococcus multilocularis	6 phosphofructokinase	0.0108	0.0567	0.1295
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0108	0.022
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0092	0.0205
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0092	0.0238
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0092	0.0238
Trichomonas vaginalis	set domain proteins, putative	0.0234	0.1302	1
Schistosoma mansoni	o-methyltransferase	0.018	0.0987	0.2278
Brugia malayi	Intermediate filament tail domain containing protein	0.0027	0.0098	0.0222
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0054	0.0122
Mycobacterium ulcerans	6-phosphofructokinase	0.0108	0.0567	0.0515
Echinococcus multilocularis	expressed conserved protein	0.01	0.0525	0.1196
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0178	0.3149
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0042	0.0302
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0208	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0054	0.0122
Loa Loa (eye worm)	hypothetical protein	0.0164	0.0893	0.2709
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0141	0.0761	0.1749
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0042	0.0066
Schistosoma mansoni	transcription factor LCR-F1	0.0075	0.0376	0.0847
Entamoeba histolytica	acetyltransferase, GNAT family	0.0039	0.017	0.2659
Echinococcus granulosus	dual specificity	0.0097	0.0504	0.1148
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0208	0.0456
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0145	0.0784	0.1805
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0075	0.0376	0.0847
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0101	0.1396
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Brugia malayi	Isocitrate dehydrogenase	0.0017	0.0042	0.0051
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0178	0.2822
Echinococcus granulosus	Niemann Pick C1 protein	0.0107	0.0562	0.1284
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0101	0.4641
Loa Loa (eye worm)	O-methyltransferase	0.018	0.0987	0.2996
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0178	0.2822
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0017	0.0008
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0043	0.019	0.0413
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0092	0.0205
Brugia malayi	hypothetical protein	0.0018	0.0045	0.006
Brugia malayi	hypothetical protein	0.0075	0.0376	0.1082
Entamoeba histolytica	hypothetical protein	0.0075	0.0376	0.6467
Echinococcus multilocularis	dual specificity	0.0097	0.0504	0.1148
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0054	0.0122
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0017	0.0042	0.0085
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0098	0.0256
Trypanosoma brucei	PAB1-binding protein , putative	0.0027	0.0101	0.1787
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0178	0.0125
Giardia lamblia	Histone acetyltransferase GCN5	0.0039	0.017	1
Entamoeba histolytica	protein kinase domain containing protein	0.0097	0.0504	0.8845
Schistosoma mansoni	hypothetical protein	0.0044	0.0199	0.0433
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0208	0.0456
Onchocerca volvulus		0.0027	0.0098	0.0047
Loa Loa (eye worm)	CMGC/DYRK/DYRK1 protein kinase	0.0097	0.0504	0.1509
Mycobacterium tuberculosis	Probable methyltransferase	0.018	0.0987	0.1076
Entamoeba histolytica	hypothetical protein	0.0097	0.0504	0.8845
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0092	0.0038
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0108	0.0567	0.0606
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0178	0.0125
Trypanosoma brucei	unspecified product	0.0034	0.0141	0.248
Leishmania major	serine/threonine-protein kinase, putative,protein kinase, putative	0.0097	0.0504	0.8845
Entamoeba histolytica	hypothetical protein	0.0075	0.0376	0.6467
Trypanosoma brucei	DNA polymerase kappa, putative	0.0021	0.0064	0.1123
Echinococcus multilocularis	dna polymerase eta	0.0014	0.0026	0.0028
Entamoeba histolytica	hypothetical protein	0.0075	0.0376	0.6467
Onchocerca volvulus		0.0027	0.0098	0.0047
Wolbachia endosymbiont of Brugia malayi	O-methyltransferase	0.018	0.0987	0.5
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.0567	0.3823
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0092	0.0038
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0114	0.0235
Brugia malayi	Pre-SET motif family protein	0.003	0.0114	0.0274
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0101	0.0267
Schistosoma mansoni	intermediate filament proteins	0.0027	0.0098	0.0196
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0092	0.0038
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.0567	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0014	0.0026	0.0028
Loa Loa (eye worm)	hypothetical protein	0.018	0.0987	0.2996
Brugia malayi	O-methyltransferase	0.018	0.0987	0.2973
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0054	0.0945
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0206	0.1137	0.3461
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0041	0.0178	0.0564
Echinococcus multilocularis	lamin	0.0027	0.0098	0.0196
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0208	0.0456
Loa Loa (eye worm)	6-phosphofructokinase	0.0108	0.0567	0.1702
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0101	0.1396
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0017	0.0042	0.0066
Schistosoma mansoni	hypothetical protein	0.0075	0.0376	0.0847
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0111	0.5425
Loa Loa (eye worm)	hypothetical protein	0.0096	0.0501	0.15
Loa Loa (eye worm)	6-phosphofructokinase	0.0108	0.0567	0.1702
Brugia malayi	polk-prov protein	0.0031	0.0121	0.0295
Schistosoma mansoni	hypothetical protein	0.0044	0.0199	0.0433
Plasmodium vivax	SET domain protein, putative	0.003	0.0114	0.4858
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0092	0.1221
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0026	0.0034
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0092	0.0205
Schistosoma mansoni	DNA polymerase eta	0.0014	0.0026	0.0028
Schistosoma mansoni	hypothetical protein	0.0044	0.0199	0.0433
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0092	0.1221
Schistosoma mansoni	lamin	0.0027	0.0098	0.0196
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0043	0.019	1
Onchocerca volvulus		0.003	0.0114	0.0183
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0097	0.0504	0.8845
Loa Loa (eye worm)	hypothetical protein	0.0107	0.0562	0.1688
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0054	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0054	0.0122
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0043	0.019	1
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0017	0.0009
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0097	0.0504	0.8845
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0208	0.0456
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0092	0.1221
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0208	0.0456
Entamoeba histolytica	protein kinase, putative	0.0097	0.0504	0.8845
Echinococcus granulosus	lamin dm0	0.0027	0.0098	0.0196
Brugia malayi	6-phosphofructokinase	0.0108	0.0567	0.1674
Schistosoma mansoni	o-methyltransferase	0.018	0.0987	0.2278
Brugia malayi	phosphofructokinase	0.0108	0.0567	0.1674
Echinococcus multilocularis	Niemann Pick C1 protein	0.0107	0.0562	0.1284
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0017	0.0008
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0092	0.0074
Mycobacterium ulcerans	methyltransferase	0.018	0.0987	0.0937
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0092	0.0238
Echinococcus granulosus	dna polymerase eta	0.0014	0.0026	0.0028
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0121	0.2138
Mycobacterium tuberculosis	Probable catechol-O-methyltransferase	0.1554	0.8956	1
Toxoplasma gondii	isocitrate dehydrogenase	0.0017	0.0042	0.1943
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0111	0.5705
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0121	0.2138
Trichomonas vaginalis	DNA polymerase eta, putative	0.0041	0.0178	0.0564
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0178	0.2822
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0092	0.0038
Brugia malayi	Niemann-Pick C1 protein precursor	0.0107	0.0562	0.1659
Echinococcus granulosus	dna polymerase kappa	0.0041	0.0178	0.0385
Echinococcus multilocularis	protein patched	0.0046	0.0208	0.0456
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0014	0.0026	0.0028
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0021	0.0064	0.0042
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0208	0.0456
Echinococcus multilocularis	musashi	0.0027	0.0098	0.0196
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.0567	0.3823
Echinococcus granulosus	lamin	0.0027	0.0098	0.0196
Plasmodium falciparum	histone acetyltransferase GCN5	0.0039	0.017	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0092	0.0038
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0092	0.0074
Trypanosoma brucei	CMGC/DYRK protein kinase, putative	0.0097	0.0504	0.8897
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Schistosoma mansoni	serine/threonine protein kinase	0.0097	0.0504	0.1148
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0101	0.5162
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0114	0.0235
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0038	0.0668
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0029	0.0111	0.158
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0114	0.0235
Brugia malayi	isocitrate dehydrogenase	0.0017	0.0042	0.0051
Entamoeba histolytica	protein kinase, putative	0.0097	0.0504	0.8845
Echinococcus granulosus	sterol regulatory element binding protein	0.0046	0.0208	0.0456
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0092	0.0038
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Echinococcus granulosus	expressed conserved protein	0.01	0.0525	0.1196
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0042	0.0066
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0111	0.5425
Leishmania major	ATP-dependent phosphofructokinase	0.0108	0.0567	1
Brugia malayi	intermediate filament protein	0.0027	0.0098	0.0222
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0111	1
Schistosoma mansoni	o-methyltransferase	0.018	0.0987	0.2278
Trichomonas vaginalis	conserved hypothetical protein	0.0046	0.0208	0.0816
Brugia malayi	CHE-14 protein	0.0046	0.0208	0.0566
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0108	0.0567	1
Echinococcus multilocularis	protein dispatched 1	0.0052	0.0246	0.0544
Echinococcus multilocularis	geminin	0.0184	0.1009	0.233
Entamoeba histolytica	hypothetical protein	0.0075	0.0376	0.6467
Brugia malayi	O-methyltransferase family protein	0.018	0.0987	0.2973
Onchocerca volvulus		0.0164	0.0893	0.6621
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0046	0.0208	0.0598
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0042	0.0302
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.0567	0.3823
Schistosoma mansoni	hypothetical protein	0.0184	0.1009	0.233
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0111	0.5705
Schistosoma mansoni	lamin	0.0027	0.0098	0.0196
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0101	0.4641
Echinococcus granulosus	Protein patched homolog 1	0.0046	0.0208	0.0456
Schistosoma mansoni	6-phosphofructokinase	0.0108	0.0567	0.1295
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0111	0.5705
Brugia malayi	hypothetical protein	0.0027	0.0101	0.0234
Leishmania major	hypothetical protein, conserved	0.0027	0.0101	0.1396
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0042	0.0066
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0048	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0121	0.0328
Echinococcus granulosus	geminin	0.0184	0.1009	0.233
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0178	0.3149
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0017	0.0042	0.0743
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0027	0.0098	0.0256
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0208	0.0565
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0178	0.3149
Loa Loa (eye worm)	hypothetical protein	0.003	0.0114	0.0307
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0043	0.019	1
Brugia malayi	acetyltransferase, GNAT family protein	0.0145	0.0784	0.2347
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0208	0.0597
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0014	0.0026	0.0028
Schistosoma mansoni	patched 1	0.0046	0.0208	0.0456
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0108	0.0567	1
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0114	0.0235
Schistosoma mansoni	hypothetical protein	0.0184	0.1009	0.233
Echinococcus multilocularis	dna polymerase kappa	0.0041	0.0178	0.0385
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0111	0.4494
Loa Loa (eye worm)	intermediate filament protein	0.0027	0.0098	0.0256

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 53 %	Cytotoxicity against human SH-SY5Y cells assessed as cell viability at 10 uM after 48 hrs by MTT assay relative to control	ChEMBL.	19344175

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

ChEMBL: CHEMBL485363

Bibliographic References

No literature references available for this target.

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Detailed information for compound 987824