TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 500.61 | Formula: C25H32N4O5S
H donors: 1 H acceptors: 4 LogP: 1.81 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: CCN(S(=O)(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1)N1CCCC1=O)N1CCOCC1)CC
InChi: 1S/C25H32N4O5S/c1-3-28(4-2)35(32,33)21-11-12-23(27-14-16-34-17-15-27)22(18-21)26-25(31)19-7-9-20(10-8-19)29-13-5-6-24(29)30/h7-12,18H,3-6,13-17H2,1-2H3,(H,26,31)
InChiKey: OUZNDQQRRWMPMO-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225

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	thyroid hormone receptor alpha	0.0191	0.0646	0.1758
Plasmodium vivax	fructose 1,6-bisphosphate aldolase, putative	0.0088	0.0254	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0051	0.011	0.1147
Echinococcus multilocularis	Squalene phytoene synthase	0.0076	0.0207	0.0551
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0088	0.0254	0.0681
Schistosoma mansoni	ATP-citrate synthase	0.0131	0.0415	0.4426
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Brugia malayi	hypothetical protein	0.0054	0.0121	0.0959
Loa Loa (eye worm)	hypothetical protein	0.003	0.0032	0.0254
Brugia malayi	hypothetical protein	0.0027	0.0019	0.0149
Leishmania major	carbonic anhydrase-like protein	0.0032	0.004	0.0405
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0024	0.0008	0.0062
Echinococcus multilocularis	musashi	0.0026	0.0016	0.0028
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0051	0.011	0.0871
Echinococcus granulosus	dna polymerase kappa	0.004	0.0069	0.0698
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0027	0.0019	0.014
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0137	0.044	0.4783
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0024	0.0008	0.0005
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0051	0.011	0.1147
Echinococcus multilocularis	lamin	0.0026	0.0016	0.0028
Onchocerca volvulus	Bile acid receptor homolog	0.0051	0.011	0.518
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.0082	0.0228	0.2454
Loa Loa (eye worm)	integrin beta-2	0.0353	0.1261	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Schistosoma mansoni	carbonic anhydrase-related	0.0032	0.004	0.0368
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0051	0.011	0.518
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0042	0.0075	0.1441
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0088	0.0254	0.0681
Loa Loa (eye worm)	fructose-bisphosphate aldolase 2	0.0088	0.0254	0.2013
Brugia malayi	nuclear receptor RXR	0.0027	0.0019	0.0149
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0051	0.011	0.1124
Trypanosoma cruzi	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Trichomonas vaginalis	glutaminase, putative	0.0266	0.0931	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0051	0.011	0.0286
Brugia malayi	acetyltransferase, GNAT family protein	0.0141	0.0455	0.3605
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0051	0.011	0.0871
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0088	0.0254	0.2735
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0024	0.0008	0.0062
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0024	0.0008	0.0021
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0024	0.0008	0.0022
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0051	0.011	0.1147
Trypanosoma brucei	DNA polymerase IV, putative	0.004	0.0069	0.0752
Brugia malayi	photoreceptor-specific nuclear receptor	0.0051	0.011	0.0871
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0051	0.011	0.0871
Schistosoma mansoni	retinoic acid receptor RXR	0.0051	0.011	0.1124
Onchocerca volvulus		0.0064	0.0161	0.7749
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0224	0.077	0.6101
Echinococcus multilocularis	integrin alpha ps	0.0077	0.0211	0.0563
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0051	0.011	0.0871
Brugia malayi	Integrin alpha pat-2 precursor	0.0172	0.0573	0.4544
Echinococcus granulosus	carbonic anhydrase	0.0032	0.004	0.0375
Echinococcus multilocularis	carbonic anhydrase	0.0032	0.004	0.0093
Loa Loa (eye worm)	ATP-citrate synthase	0.0149	0.0485	0.3846
Schistosoma mansoni	coup transcription factor	0.0051	0.011	0.1124
Brugia malayi	Steroid receptor seven-up type 2	0.0051	0.011	0.0871
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.0082	0.0228	0.0611
Echinococcus granulosus	integrin alpha 3	0.0132	0.042	0.4566
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0051	0.011	0.1124
Trypanosoma brucei	fructose-bisphosphate aldolase, glycosomal, putative	0.0088	0.0254	0.2949
Onchocerca volvulus	NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog	0.0076	0.0207	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.005	0.0122
Brugia malayi	hypothetical protein	0.0024	0.0008	0.0062
Trypanosoma brucei	DNA polymerase IV, putative	0.0034	0.0045	0.0461
Loa Loa (eye worm)	hypothetical protein	0.0095	0.0279	0.2211
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0051	0.011	0.1124
Echinococcus granulosus	carbonic anhydrase II	0.0032	0.004	0.0375
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0042	0.0075	0.1441
Schistosoma mansoni	hypothetical protein	0.0035	0.005	0.048
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.005	0.049
Schistosoma mansoni	aldehyde dehydrogenase	0.0068	0.0175	0.1833
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0051	0.011	0.1147
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0024	0.0008	0.0022
Echinococcus granulosus	ecdysone induced protein 78C	0.0051	0.011	0.1147
Echinococcus granulosus	Squalene phytoene synthase	0.0076	0.0207	0.2215
Brugia malayi	nuclear hormone receptor family member odr-7	0.0024	0.0008	0.0062
Schistosoma mansoni	hypothetical protein	0.0032	0.004	0.0368
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Echinococcus multilocularis	carbonic anhydrase II	0.0032	0.004	0.0093
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0024	0.0008	0.0022
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0019	0.0149
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0088	0.0254	0.2949
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.01	0.0795
Brugia malayi	Integrin beta pat-3 precursor	0.0353	0.1261	1
Mycobacterium ulcerans	DNA polymerase IV	0.004	0.0069	0.0063
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0051	0.011	0.0871
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0051	0.011	0.1147
Brugia malayi	steroid hormone receptor	0.0051	0.011	0.0871
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0141	0.0453	0.1228
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0068	0.0175	0.0466
Echinococcus granulosus	carbonic anhydrase	0.0032	0.004	0.0375
Echinococcus granulosus	lamin	0.0026	0.0016	0.0112
Trypanosoma cruzi	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0042	0.0075	0.0762
Brugia malayi	Nuclear hormone receptor-like 1	0.0027	0.0019	0.0149
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0051	0.011	0.0871
Echinococcus granulosus	thyroid hormone receptor alpha	0.0024	0.0008	0.0022
Toxoplasma gondii	hypothetical protein	0.0032	0.004	0.071
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0051	0.011	0.1147
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0051	0.011	0.0871
Wolbachia endosymbiont of Brugia malayi	succinyl-CoA synthetase, alpha subunit	0.0023	0.0006	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0051	0.011	0.0871
Onchocerca volvulus		0.0024	0.0008	0.0099
Brugia malayi	intermediate filament protein	0.0026	0.0016	0.0127
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0088	0.0254	0.2735
Loa Loa (eye worm)	hypothetical protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Trypanosoma brucei	unspecified product	0.0034	0.0045	0.0461
Echinococcus granulosus	integrin alpha ps	0.0037	0.0058	0.0573
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0032	0.004	0.0316
Schistosoma mansoni	nuclear hormone receptor	0.0024	0.0008	0.0021
Loa Loa (eye worm)	glutaminase	0.0266	0.0931	0.7385
Trypanosoma cruzi	squalene synthase, putative	0.0244	0.0847	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0024	0.0008	0.0005
Giardia lamblia	Histone acetyltransferase GCN5	0.0038	0.0062	0.5
Echinococcus granulosus	jun protein	0.0082	0.0228	0.2454
Trichomonas vaginalis	DNA polymerase eta, putative	0.004	0.0069	0.0684
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0051	0.011	0.0871
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0051	0.011	0.0871
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.004	0.0069	0.0684
Schistosoma mansoni	integrin alpha-ps	0.004	0.007	0.0692
Loa Loa (eye worm)	integrin alpha pat-2	0.0265	0.0929	0.7363
Schistosoma mansoni	integrin alpha	0.0172	0.0573	0.6129
Echinococcus multilocularis	FTZ F1 alpha	0.0051	0.011	0.0286
Trypanosoma cruzi	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Echinococcus multilocularis	integrin alpha ps	0.0037	0.0058	0.0143
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Brugia malayi	nuclear receptor NHR-88	0.0051	0.011	0.0871
Entamoeba histolytica	acetyltransferase, GNAT family	0.0038	0.0062	1
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0058	0.0458
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0042	0.0335
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0051	0.011	0.0286
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0068	0.0175	0.017
Toxoplasma gondii	aldehyde dehydrogenase	0.0068	0.0175	0.354
Brugia malayi	Kelch motif family protein	0.0054	0.0121	0.0959
Mycobacterium tuberculosis	3-dehydroquinate dehydratase AroD (AROQ) (3-dehydroquinase) (type II dhqase)	0.2646	1	1
Brugia malayi	succinyl-CoA ligase [GDP-forming] alpha-chain, mitochindrial	0.0023	0.0006	0.0046
Brugia malayi	Nuclear hormone receptor-like 1	0.0051	0.011	0.0871
Schistosoma mansoni	thyroid hormone receptor	0.0191	0.0646	0.6921
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0027	0.0019	0.0149
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0051	0.011	0.1147
Loa Loa (eye worm)	steroid hormone receptor	0.0051	0.011	0.0871
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0979	0.3649	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0068	0.0175	0.017
Trypanosoma cruzi	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0068	0.0175	0.017
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0051	0.011	0.0286
Brugia malayi	ecdysone receptor	0.0024	0.0008	0.0062
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0088	0.0254	0.2735
Brugia malayi	tailless protein	0.0024	0.0008	0.0062
Schistosoma mansoni	RAR-like nuclear receptor	0.0051	0.011	0.1124
Leishmania major	hypothetical protein, conserved	0.0076	0.0207	0.2388
Brugia malayi	hypothetical protein	0.0024	0.0008	0.0062
Brugia malayi	polk-prov protein	0.003	0.0032	0.0254
Trypanosoma cruzi	squalene synthase, putative	0.0244	0.0847	1
Loa Loa (eye worm)	glutaminase 2	0.0266	0.0931	0.7385
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0088	0.0254	0.268
Brugia malayi	Nuclear hormone receptor E75	0.0024	0.0008	0.0062
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0027	0.0019	0.0035
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0042	0.0075	0.2785
Brugia malayi	hypothetical protein	0.0064	0.0161	0.128
Trypanosoma brucei	DNA polymerase kappa, putative	0.003	0.0032	0.0312
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0088	0.0254	0.2949
Schistosoma mansoni	jun-related protein	0.0066	0.017	0.1774
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.01	0.0795
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0051	0.011	0.0871
Schistosoma mansoni	hypothetical protein	0.0033	0.0042	0.0393
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0019	0.0149
Schistosoma mansoni	hypothetical protein	0.0076	0.0207	0.217
Onchocerca volvulus		0.0051	0.011	0.518
Echinococcus granulosus	fructose bisphosphate aldolase class I	0.0088	0.0254	0.2735
Toxoplasma gondii	ATP-citrate lyase, putative	0.0149	0.0485	1
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0068	0.0175	0.2017
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0016	0.0127
Echinococcus granulosus	integrin beta 2	0.0261	0.0913	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0051	0.011	0.0286
Echinococcus multilocularis	fructose bisphosphate aldolase class I	0.0088	0.0254	0.0681
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0051	0.011	0.1124
Trypanosoma brucei	DNA polymerase kappa, putative	0.003	0.0032	0.0312
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.005	0.048
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0019	0.0149
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0024	0.0008	0.0005
Trypanosoma brucei	DNA polymerase IV, putative	0.004	0.0069	0.0752
Brugia malayi	orphan nuclear receptor NR2E1	0.0024	0.0008	0.0062
Brugia malayi	bZIP transcription factor family protein	0.0082	0.0228	0.1811
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0024	0.0008	0.0021
Schistosoma mansoni	thyroid hormone receptor	0.0191	0.0646	0.6921
Schistosoma mansoni	nuclear receptor nhr-48	0.0024	0.0008	0.0021
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0141	0.0455	0.1232
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0051	0.011	0.0871
Echinococcus multilocularis	jun protein	0.0082	0.0228	0.0611
Loa Loa (eye worm)	hypothetical protein	0.008	0.022	0.1743
Brugia malayi	ecdysteroid receptor	0.0051	0.011	0.0871
Brugia malayi	glutaminase DH11.1	0.0266	0.0931	0.7385
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0024	0.0008	0.0022
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Schistosoma mansoni	carbonic anhydrase	0.0032	0.004	0.0368
Echinococcus multilocularis	lamin dm0	0.0026	0.0016	0.0028
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0088	0.0254	0.0681
Brugia malayi	nuclear receptor NHR-67	0.0024	0.0008	0.0062
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0016	0.011
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Schistosoma mansoni	hypothetical protein	0.0066	0.017	0.1774
Loa Loa (eye worm)	hypothetical protein	0.0032	0.004	0.0316
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0088	0.0254	0.268
Loa Loa (eye worm)	acetyltransferase	0.0141	0.0455	0.3605
Leishmania major	squalene synthase, putative	0.0244	0.0847	1
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0032	0.004	0.0316
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0024	0.0008	0.0099
Echinococcus granulosus	carbonic anhydrase	0.0032	0.004	0.0375
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.01	0.0795
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0088	0.0254	0.2949
Brugia malayi	hypothetical protein	0.0027	0.0019	0.0149
Loa Loa (eye worm)	succinate-CoA ligase	0.0023	0.0006	0.0046
Echinococcus granulosus	nuclear receptor nhr 48	0.0024	0.0008	0.0022
Mycobacterium ulcerans	phytoene synthase, CrtB	0.0076	0.0207	0.0201
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0051	0.011	0.0871
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0016	0.0127
Loa Loa (eye worm)	kelch domain-containing protein family protein	0.0054	0.0121	0.0959
Plasmodium falciparum	fructose-bisphosphate aldolase	0.0088	0.0254	1
Schistosoma mansoni	hypothetical protein	0.0037	0.0058	0.0561
Schistosoma mansoni	zinc finger protein	0.0024	0.0008	0.0021
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0141	0.0455	0.485
Echinococcus multilocularis	carbonic anhydrase	0.0032	0.004	0.0093
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0068	0.0175	0.1871
Mycobacterium ulcerans	glutaminase	0.0266	0.0931	0.0926
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0014	0.0113
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0019	0.0149
Trypanosoma brucei	carbonic anhydrase-like protein	0.0032	0.004	0.0405
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0051	0.011	0.0871
Schistosoma mansoni	glutaminase	0.0266	0.0931	1
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0032	0.004	0.0405
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0032	0.004	0.0405
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0051	0.011	0.0286
Plasmodium falciparum	histone acetyltransferase GCN5	0.0038	0.0062	0.2253
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0051	0.011	0.0871
Echinococcus multilocularis	integrin alpha 3	0.0132	0.042	0.1137
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0024	0.0008	0.0099
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Onchocerca volvulus		0.0026	0.0016	0.0506
Loa Loa (eye worm)	hypothetical protein	0.013	0.0413	0.3276
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0068	0.0175	0.017
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0051	0.011	0.0871
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0088	0.0254	0.5176
Echinococcus multilocularis	integrin beta 2	0.0261	0.0913	0.2489
Loa Loa (eye worm)	DR-78	0.0024	0.0008	0.0062
Chlamydia trachomatis	succinyl-CoA ligase subunit alpha	0.0023	0.0006	0.5
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0051	0.011	0.0871
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0042	0.0335
Brugia malayi	nuclear receptor RXR	0.0024	0.0008	0.0062
Schistosoma mansoni	carbonic anhydrase-related	0.0032	0.004	0.0368
Brugia malayi	Nuclear hormone receptor E75	0.0024	0.0008	0.0062
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	carbonic anhydrase 3	0.0032	0.004	0.0316
Schistosoma mansoni	lamin	0.0026	0.0016	0.011
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0042	0.0075	0.0746
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0032	0.004	0.0316
Schistosoma mansoni	nuclear receptor	0.0024	0.0008	0.0021
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0024	0.0008	0.0005
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0051	0.011	0.1124
Schistosoma mansoni	integrin alpha-ps	0.0077	0.0211	0.2216
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0051	0.011	0.0871
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0088	0.0254	0.5176
Schistosoma mansoni	hypothetical protein	0.0141	0.0453	0.4834
Echinococcus granulosus	intermediate filament protein	0.0026	0.0016	0.0112
Schistosoma mansoni	nuclear hormone receptor	0.0024	0.0008	0.0021
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0027	0.0019	0.0142
Echinococcus multilocularis	integrin alpha ps	0.0077	0.0211	0.0563
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0207	0.1639
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0051	0.011	0.0871
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0024	0.0008	0.0005
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0042	0.0075	0.0746
Trypanosoma brucei	squalene synthase, putative	0.0244	0.0847	1
Echinococcus granulosus	integrin alpha ps	0.0077	0.0211	0.2262
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0016	0.0127
Brugia malayi	Nuclear hormone receptor-like 1	0.0027	0.0019	0.0149
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Brugia malayi	nuclear hormone receptor	0.0024	0.0008	0.0062
Toxoplasma gondii	fructose-bisphosphate aldolase, putative	0.0088	0.0254	0.5176
Schistosoma mansoni	aldehyde dehydrogenase	0.0068	0.0175	0.1833
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0141	0.0453	0.4933
Brugia malayi	fructose-bisphosphate aldolase 1	0.0088	0.0254	0.2013
Brugia malayi	fructose-bisphosphate aldolase 2	0.0088	0.0254	0.2013
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0051	0.011	0.0286
Brugia malayi	Integrin alpha cytoplasmic region family protein	0.013	0.0413	0.3276
Onchocerca volvulus		0.0024	0.0008	0.0099
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0051	0.011	0.1124
Echinococcus multilocularis	dna polymerase kappa	0.004	0.0069	0.0174
Brugia malayi	ATP-citrate synthase	0.0149	0.0485	0.3846
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Schistosoma mansoni	lamin	0.0026	0.0016	0.011
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Schistosoma mansoni	carbonic anhydrase-related	0.0032	0.004	0.0368
Onchocerca volvulus	Protein ultraspiracle homolog	0.0051	0.011	0.518
Leishmania major	fructose-1,6-bisphosphate aldolase	0.0088	0.0254	0.2949
Brugia malayi	hypothetical protein	0.0035	0.005	0.0398
Loa Loa (eye worm)	nuclear hormone receptor	0.0024	0.0008	0.0062
Schistosoma mansoni	integrin beta subunit	0.0208	0.0708	0.7591
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0121	0.0959
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Loa Loa (eye worm)	hypothetical protein	0.0048	0.01	0.0795
Loa Loa (eye worm)	hypothetical protein	0.0051	0.011	0.0871
Echinococcus multilocularis	carbonic anhydrase	0.0032	0.004	0.0093
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Loa Loa (eye worm)	fructose-bisphosphate aldolase 1	0.0088	0.0254	0.2013
Loa Loa (eye worm)	hypothetical protein	0.0032	0.004	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0019	0.0149
Brugia malayi	nuclear hormone receptor	0.0051	0.011	0.0871
Mycobacterium tuberculosis	Probable phytoene synthase PhyA	0.0076	0.0207	0.0201
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0032	0.004	0.0316
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0024	0.0008	0.0062
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0051	0.011	0.0871
Schistosoma mansoni	nuclear receptor	0.0024	0.0008	0.0021
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0088	0.0254	0.2949
Echinococcus multilocularis	nuclear receptor nhr 48	0.0024	0.0008	0.0005
Brugia malayi	conserved hypotetical protein	0.0024	0.0008	0.0062
Plasmodium falciparum	carbonic anhydrase	0.0032	0.004	0.1372
Brugia malayi	nuclear receptor NHR-88	0.0024	0.0008	0.0062
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0032	0.004	0.0368
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0051	0.011	0.1124
Mycobacterium ulcerans	3-dehydroquinate dehydratase	0.2646	1	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0027	0.0019	0.014
Mycobacterium ulcerans	DNA polymerase IV	0.004	0.0069	0.0063
Trypanosoma brucei	DNA polymerase kappa, putative	0.004	0.0069	0.0752
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Echinococcus granulosus	FTZ F1 alpha	0.0051	0.011	0.1147
Echinococcus granulosus	lamin dm0	0.0026	0.0016	0.0112
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0032	0.004	0.0316
Echinococcus multilocularis	ecdysone induced protein 78C	0.0051	0.011	0.0286
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0008	0.0062
Brugia malayi	follicle stimulating hormone receptor	0.0224	0.077	0.6101
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0024	0.0008	0.0062
Loa Loa (eye worm)	hypothetical protein	0.0135	0.0432	0.3426
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0016	0.0127
Onchocerca volvulus		0.0026	0.0016	0.0506
Loa Loa (eye worm)	hypothetical protein	0.004	0.007	0.0554
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0032	0.004	0.0368
Trypanosoma cruzi	phytoene synthase, putative	0.0076	0.0207	0.2388
Schistosoma mansoni	nuclear hormone receptor	0.0051	0.011	0.1124

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	7.3753 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	7.9433 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	14.575 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	14.7157 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
Homo sapiens	ChEMBL23

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: CHEMBL1551124

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1414858