TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 330.464 | Formula: C20H30N2O2
H donors: 1 H acceptors: 1 LogP: 4.83 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CC(CNCc1coc(n1)c1ccc(cc1)OCC(C)(C)C)(C)C
InChi: 1S/C20H30N2O2/c1-19(2,3)13-21-11-16-12-23-18(22-16)15-7-9-17(10-8-15)24-14-20(4,5)6/h7-10,12,21H,11,13-14H2,1-6H3
InChiKey: IWWNNUVWGFGIPL-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	diuretic hormone 44 receptor GPRdih2	0.0015	0.0021	0.0029
Echinococcus multilocularis	dihydrofolate reductase	0.0963	0.2878	0.4056
Entamoeba histolytica	hypothetical protein	0.0033	0.0073	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Brugia malayi	Calcium binding EGF domain containing protein	0.0358	0.1054	0.1485
Echinococcus granulosus	enteropeptidase	0.0887	0.265	0.3734
Onchocerca volvulus		0.0352	0.1037	0.1457
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Echinococcus granulosus	delta-like protein 1	0.0358	0.1054	0.1485
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0044	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0044	0.0062
Onchocerca volvulus		0.0291	0.0851	0.1195
Schistosoma mansoni	voltage-gated potassium channel	0.0011	0.0007	0.0004
Schistosoma mansoni	septate junction protein	0.0358	0.1054	0.148
Brugia malayi	Kringle domain containing protein	0.0861	0.257	0.3622
Brugia malayi	Trypsin family protein	0.0352	0.1037	0.1461
Brugia malayi	Delta serrate ligand family protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	PAN domain-containing protein	0.0291	0.0851	0.12
Toxoplasma gondii	PAN domain-containing protein	0.1408	0.422	0.4141
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0044	0.0062
Onchocerca volvulus		0.0358	0.1054	0.148
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0154	0.0212
Echinococcus granulosus	laminin	0.0737	0.2198	0.3098
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0021	0.0029
Onchocerca volvulus		0.0861	0.257	0.3619
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0059	0.0083
Onchocerca volvulus		0.0291	0.0851	0.1195
Brugia malayi	Latrophilin receptor protein 2	0.0015	0.0021	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Schistosoma mansoni	hypothetical protein	0.0033	0.0075	0.01
Schistosoma mansoni	hypothetical protein	0.0155	0.0442	0.0617
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.3324	1	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0059	0.0083
Loa Loa (eye worm)	PAN domain-containing protein	0.0291	0.0851	0.12
Echinococcus granulosus	neurogenic locus protein delta	0.0358	0.1054	0.1485
Loa Loa (eye worm)	PAN domain-containing protein	0.0291	0.0851	0.12
Onchocerca volvulus		0.1502	0.4504	0.6345
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0026	0.0004
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0011	0.0007	0.0009
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0044	0.0025
Brugia malayi	Trypsin family protein	0.0352	0.1037	0.1461
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0075	0.0105
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Brugia malayi	Cadherin domain containing protein	0.0358	0.1054	0.1485
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0004	0.0006
Onchocerca volvulus		0.0291	0.0851	0.1195
Brugia malayi	hypothetical protein	0.0352	0.1037	0.1461
Onchocerca volvulus		0.0358	0.1054	0.148
Echinococcus granulosus	neural cadherin	0.0358	0.1054	0.1485
Echinococcus multilocularis	enteropeptidase	0.0887	0.265	0.3734
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.0098	0.0132
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0038	0.0087	0.0123
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0004	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Echinococcus granulosus	fibropellin Ia	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	steroid hormone receptor	0.001	0.0004	0.0006
Brugia malayi	thymidylate synthase	0.2361	0.7096	1
Schistosoma mansoni	hypothetical protein	0.0861	0.257	0.3619
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0015	0.0021	0.0029
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0004	0.0006
Toxoplasma gondii	hypothetical protein	0.0291	0.0851	0.0726
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Echinococcus granulosus	cpg binding protein	0.003	0.0064	0.0089
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Schistosoma mansoni	hypothetical protein	0.0015	0.0021	0.0024
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0004	0.0005
Onchocerca volvulus		0.0291	0.0851	0.1195
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0044	0.0062
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0004	0.0005
Echinococcus multilocularis	fat cadherin tumor suppressor	0.0358	0.1054	0.1485
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0033	0.0073	0.0103
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0004	0.0006
Toxoplasma gondii	EGF family domain-containing protein	0.0358	0.1054	0.0931
Brugia malayi	nuclear hormone receptor	0.001	0.0004	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	neuropeptide s receptor	0.0423	0.125	0.1761
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.0963	0.2878	0.4036
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0033	0.0073	0.0103
Schistosoma mansoni	subfamily M12A unassigned peptidase (M12 family)	0.0737	0.2198	0.3094
Brugia malayi	hypothetical protein	0.0033	0.0073	0.0103
Echinococcus granulosus	neuropeptide receptor A26	0.0423	0.125	0.1761
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0011	0.0007	0.001
Toxoplasma gondii	PAN domain-containing protein	0.0291	0.0851	0.0726
Loa Loa (eye worm)	hypothetical protein	0.0737	0.2198	0.3098
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Entamoeba histolytica	hypothetical protein	0.0033	0.0073	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0004	0.0005
Schistosoma mansoni	hypothetical protein	0.0015	0.0021	0.0024
Brugia malayi	Calcium binding EGF domain containing protein	0.0358	0.1054	0.1485
Brugia malayi	Calcium binding EGF domain containing protein	0.0737	0.2198	0.3098
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.1502	0.4504	0.6345
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Entamoeba histolytica	hypothetical protein	0.0033	0.0073	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0044	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Toxoplasma gondii	PAN domain-containing protein	0.0291	0.0851	0.0726
Echinococcus multilocularis	laminin	0.0737	0.2198	0.3098
Echinococcus granulosus	tissue type plasminogen activator	0.0861	0.257	0.3622
Onchocerca volvulus		0.0358	0.1054	0.148
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0004	0.0006
Echinococcus multilocularis	Tolloid protein 1	0.0737	0.2198	0.3098
Schistosoma mansoni	dihydrofolate reductase	0.0963	0.2878	0.4053
Brugia malayi	ecdysteroid receptor	0.001	0.0004	0.0006
Brugia malayi	dihydrofolate reductase family protein	0.0963	0.2878	0.4056
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.1502	0.4504	0.6345
Toxoplasma gondii	kringle domain-containing protein	0.0861	0.257	0.2469
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0004	0.0006
Echinococcus multilocularis	geminin	0.0155	0.0442	0.0622
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	PAN domain-containing protein	0.0291	0.0851	0.12
Schistosoma mansoni	cpg binding protein	0.003	0.0064	0.0084
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.0098	0.0132
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0026	0.0037
Echinococcus multilocularis	dnaJ subfamily B	0.0401	0.1183	0.1667
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0004	0.0005
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Toxoplasma gondii	calcium binding egf domain-containing protein	0.0737	0.2198	0.2092
Echinococcus multilocularis	neurogenic locus protein delta	0.0358	0.1054	0.1485
Onchocerca volvulus		0.0291	0.0851	0.1195
Echinococcus granulosus	thymidylate synthase	0.2361	0.7096	1
Echinococcus granulosus	protein jagged 2	0.0358	0.1054	0.1485
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0352	0.1037	0.1457
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0004	0.0005
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.0963	0.2878	0.4019
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0044	0.0062
Brugia malayi	notch-like transmembrane receptor	0.0358	0.1054	0.1485
Schistosoma mansoni	voltage-gated potassium channel	0.0011	0.0007	0.0004
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Toxoplasma gondii	subtilisin SUB12	0.0291	0.0851	0.0726
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0072	0.0101
Schistosoma mansoni	hypothetical protein	0.0015	0.0021	0.0024
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Toxoplasma gondii	microneme protein MIC17A	0.0291	0.0851	0.0726
Loa Loa (eye worm)	thymidylate synthase	0.2361	0.7096	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Echinococcus granulosus	Mastin	0.0887	0.265	0.3734
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0044	0.0025
Echinococcus multilocularis	Mastin	0.0887	0.265	0.3734
Entamoeba histolytica	hypothetical protein	0.0033	0.0073	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	Muscle positioning protein 4	0.0358	0.1054	0.1485
Echinococcus granulosus	Tolloid protein 1	0.0737	0.2198	0.3098
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0004	0.0005
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Onchocerca volvulus	Slit protein homolog	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0352	0.1037	0.1461
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0121	0.0171
Toxoplasma gondii	1,3(4)-beta-glucanase	0.0291	0.0851	0.0726
Schistosoma mansoni	laminin gamma-3 chain	0.0358	0.1054	0.148
Loa Loa (eye worm)	dihydrofolate reductase	0.0963	0.2878	0.4056
Echinococcus multilocularis	neuropeptide receptor A26	0.0423	0.125	0.1761
Schistosoma mansoni	egf-like domain protein	0.0737	0.2198	0.3094
Toxoplasma gondii	microneme protein MIC17C	0.0291	0.0851	0.0726
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0038	0.0087	0.0123
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0352	0.1037	0.1461
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0004	0.0006
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0004	0.0006
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0004	0.0005
Mycobacterium leprae	PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE)	0.2361	0.7096	1
Toxoplasma gondii	hypothetical protein	0.0291	0.0851	0.0726
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0352	0.1037	0.1457
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0044	0.0025
Onchocerca volvulus	Neurogenic locus notch homolog	0.0358	0.1054	0.148
Echinococcus granulosus	notch	0.0358	0.1054	0.1485
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0004	0.0005
Toxoplasma gondii	PAN domain-containing protein	0.0291	0.0851	0.0726
Brugia malayi	Protein kinase domain containing protein	0.0861	0.257	0.3622
Echinococcus granulosus	voltage gated potassium channel	0.0011	0.0007	0.0009
Onchocerca volvulus		0.1149	0.3441	0.4846
Loa Loa (eye worm)	hypothetical protein	0.0737	0.2198	0.3098
Brugia malayi	Dihydrofolate reductase	0.0963	0.2878	0.4056
Echinococcus multilocularis	neurogenic locus notch protein	0.0358	0.1054	0.1485
Brugia malayi	Fibulin-1 precursor	0.0737	0.2198	0.3098
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0011	0.0007	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0352	0.1037	0.1461
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0044	0.0025
Onchocerca volvulus		0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0352	0.1037	0.1461
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0026	0.0037
Brugia malayi	nuclear receptor NHR-88	0.001	0.0004	0.0006
Mycobacterium ulcerans	thymidylate synthase	0.2361	0.7096	1
Onchocerca volvulus	Arrow homolog	0.0737	0.2198	0.3094
Loa Loa (eye worm)	hypothetical protein	0.0861	0.257	0.3622
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0121	0.0171
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0004	0.0005
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0004	0.0006
Schistosoma mansoni	cpg binding protein	0.003	0.0064	0.0084
Toxoplasma gondii	PAN/Apple domain-containing protein	0.0291	0.0851	0.0726
Loa Loa (eye worm)	multiple epidermal growth factor-like domains 6	0.0737	0.2198	0.3098
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0038	0.0087	0.0123
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0004	0.0005
Brugia malayi	hypothetical protein	0.1123	0.3362	0.4738
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.2361	0.7096	1
Onchocerca volvulus		0.0352	0.1037	0.1457
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0004	0.0006
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0352	0.1037	0.1457
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0004	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Echinococcus multilocularis	notch	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Echinococcus multilocularis	fibropellin Ia	0.0358	0.1054	0.1485
Onchocerca volvulus		0.0352	0.1037	0.1457
Toxoplasma gondii	microneme protein, putative	0.0291	0.0851	0.0726
Toxoplasma gondii	PAN domain-containing protein	0.1408	0.422	0.4141
Onchocerca volvulus	Neurogenic locus notch protein homolog	0.0358	0.1054	0.148
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.3324	1	1
Onchocerca volvulus		0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0004	0.0006
Echinococcus granulosus	protein jagged 1	0.0358	0.1054	0.1485
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.3324	1	0.5
Brugia malayi	Trypsin family protein	0.0352	0.1037	0.1461
Giardia lamblia	High cysteine protein	0.0358	0.1054	0.5
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Schistosoma mansoni	cell polarity protein	0.0358	0.1054	0.148
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Echinococcus multilocularis	GPCR, family 2	0.0015	0.0021	0.0029
Echinococcus multilocularis	cpg binding protein	0.003	0.0064	0.0089
Toxoplasma gondii	calcium binding egf domain-containing protein	0.0737	0.2198	0.2092
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0015	0.0021	0.0029
Loa Loa (eye worm)	low-density lipoprotein receptor repeat class B containing protein	0.0737	0.2198	0.3098
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Brugia malayi	Trypsin family protein	0.1502	0.4504	0.6347
Onchocerca volvulus		0.2361	0.7096	1
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0004	0.0005
Toxoplasma gondii	microneme protein MIC4	0.0291	0.0851	0.0726
Echinococcus granulosus	GPCR family 2	0.0015	0.0021	0.0029
Echinococcus granulosus	geminin	0.0155	0.0442	0.0622
Leishmania major	hypothetical protein, conserved	0.0861	0.257	0.2537
Loa Loa (eye worm)	PAN domain-containing protein	0.0291	0.0851	0.12
Onchocerca volvulus		0.0028	0.0059	0.0078
Schistosoma mansoni	hypothetical protein	0.0401	0.1183	0.1662
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0026	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0044	0.0062
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	GCC2 and GCC3 family protein	0.0358	0.1054	0.1485
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.3324	1	1
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Onchocerca volvulus		0.0291	0.0851	0.1195
Brugia malayi	Trypsin-like protease protein 5	0.0352	0.1037	0.1461
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0004	0.0005
Schistosoma mansoni	hypothetical protein	0.0033	0.0073	0.0098
Echinococcus multilocularis	protein jagged 2	0.0358	0.1054	0.1485
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.0963	0.2878	0.4034
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0007	0.0009
Onchocerca volvulus		0.0291	0.0851	0.1195
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0352	0.1037	0.1461
Toxoplasma gondii	PAN domain-containing protein	0.0291	0.0851	0.0726
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0044	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Onchocerca volvulus	Putative cubilin	0.0358	0.1054	0.148
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0004	0.0006
Echinococcus granulosus	protein jagged 2	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0004	0.0005
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0026	0.0037
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0004	0.0005
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0038	0.0087	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Onchocerca volvulus		0.0023	0.0044	0.0057
Echinococcus multilocularis	fibrillin 1	0.0737	0.2198	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0015	0.0021	0.0029
Loa Loa (eye worm)	hypothetical protein	0.1502	0.4504	0.6347
Mycobacterium ulcerans	hypothetical protein	0.0352	0.1037	0.143
Schistosoma mansoni	hypothetical protein	0.0352	0.1037	0.1457
Loa Loa (eye worm)	hypothetical protein	0.0737	0.2198	0.3098
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0352	0.1037	0.1461
Loa Loa (eye worm)	hypothetical protein	0.0291	0.0851	0.12
Schistosoma mansoni	hypothetical protein	0.0352	0.1037	0.1457
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0044	0.0025
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.2361	0.7096	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0004	0.0006
Loa Loa (eye worm)	trypsin family protein	0.0352	0.1037	0.1461
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	Notch2	0.0358	0.1054	0.1485
Echinococcus granulosus	neurogenic locus notch protein	0.0358	0.1054	0.1485
Brugia malayi	Cadherin domain containing protein	0.0358	0.1054	0.1485
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0004	0.0006
Echinococcus multilocularis	neurogenic locus protein delta	0.0358	0.1054	0.1485
Onchocerca volvulus		0.0291	0.0851	0.1195
Echinococcus granulosus	neurogenic locus notch protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0352	0.1037	0.1461
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0004	0.0005
Echinococcus granulosus	neuropeptide s receptor	0.0423	0.125	0.1761
Echinococcus multilocularis	protein jagged 1	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.1502	0.4504	0.6347
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Onchocerca volvulus		0.0291	0.0851	0.1195
Mycobacterium tuberculosis	Hypothetical protein	0.1123	0.3362	0.4721
Plasmodium falciparum	cysteine repeat modular protein 1	0.0861	0.257	0.2551
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0887	0.265	0.3731
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	Calcium binding EGF domain containing protein	0.0358	0.1054	0.1485
Loa Loa (eye worm)	hypothetical protein	0.0737	0.2198	0.3098
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Trichomonas vaginalis	conserved hypothetical protein	0.1123	0.3362	1
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Echinococcus granulosus	transmembrane protease serine 3	0.0352	0.1037	0.1461
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0004	0.0005
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0015	0.0021	0.0029
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0352	0.1037	0.1461
Onchocerca volvulus		0.0352	0.1037	0.1457
Onchocerca volvulus		0.0352	0.1037	0.1457
Schistosoma mansoni	slit	0.0358	0.1054	0.148
Onchocerca volvulus		0.0291	0.0851	0.1195
Loa Loa (eye worm)	notch protein	0.0358	0.1054	0.1485
Echinococcus granulosus	glycoprotein Antigen 5	0.0887	0.265	0.3734
Echinococcus multilocularis	transmembrane protease serine 3	0.0352	0.1037	0.1461
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0026	0.0037
Echinococcus granulosus	slit 2 protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0004	0.0005
Echinococcus multilocularis	protein jagged 1	0.0358	0.1054	0.1485
Echinococcus granulosus	protein jagged 1	0.0358	0.1054	0.1485
Loa Loa (eye worm)	TK/ROR protein kinase	0.0861	0.257	0.3622
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0044	0.0029
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase, putative	0.1123	0.3362	0.1066
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Echinococcus multilocularis	neurogenic locus notch protein 4	0.0358	0.1054	0.1485
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0044	0.0062
Plasmodium vivax	cysteine repeat modular protein 1, putative	0.0861	0.257	0.2551
Echinococcus multilocularis	glycoprotein Antigen 5	0.0887	0.265	0.3734
Schistosoma mansoni	hypothetical protein	0.0358	0.1054	0.148
Echinococcus granulosus	dnaJ subfamily B	0.0401	0.1183	0.1667
Schistosoma mansoni	hypothetical protein	0.0155	0.0442	0.0617
Brugia malayi	PAN domain containing protein	0.0291	0.0851	0.12
Schistosoma mansoni	hypothetical protein	0.0015	0.0021	0.0024
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0004	0.0005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Toxoplasma gondii	microneme protein MIC17B	0.0291	0.0851	0.0726
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0004	0.0006
Echinococcus multilocularis	neural cadherin	0.0358	0.1054	0.1485
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0352	0.1037	0.1457
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0004	0.0005
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0121	0.0171
Schistosoma mansoni	transcription factor LCR-F1	0.0033	0.0073	0.0098
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0004	0.0005
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0075	0.0105
Echinococcus granulosus	neurogenic locus notch protein 4	0.0358	0.1054	0.1485
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0004	0.0005
Schistosoma mansoni	cpg binding protein	0.0028	0.0059	0.0078
Echinococcus granulosus	dihydrofolate reductase	0.0963	0.2878	0.4056
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0358	0.1054	0.1485
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0352	0.1037	0.1457
Onchocerca volvulus		0.0291	0.0851	0.1195
Loa Loa (eye worm)	hypothetical protein	0.0352	0.1037	0.1461
Brugia malayi	Low-density lipoprotein receptor repeat class B containing protein	0.0737	0.2198	0.3098
Echinococcus multilocularis	slit 2 protein	0.0358	0.1054	0.1485
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.3324	1	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0004	0.0005
Schistosoma mansoni	cercarial elastase (S01 family)	0.0352	0.1037	0.1457
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0121	0.0171
Schistosoma mansoni	notch	0.0358	0.1054	0.148
Loa Loa (eye worm)	bone morphogenetic protein 1b	0.0737	0.2198	0.3098
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0004	0.0005
Echinococcus multilocularis	tissue type plasminogen activator	0.0861	0.257	0.3622
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0044	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0737	0.2198	0.3098
Echinococcus multilocularis	voltage gated potassium channel	0.0011	0.0007	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0358	0.1054	0.1485
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0015	0.0021	0.0029
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0004	0.0005
Chlamydia trachomatis	dihydrofolate reductase	0.0963	0.2878	1
Echinococcus multilocularis	thymidylate synthase	0.2361	0.7096	1
Brugia malayi	EGF-like domain containing protein	0.0358	0.1054	0.1485
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0352	0.1037	0.1461
Echinococcus multilocularis	neurogenic locus notch protein	0.0358	0.1054	0.1485

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.42 ug/ml	DNDI: Inhibition of Human African Trypanosomiasis, SBRI 427, in vitro	ChEMBL.	No reference
IC50	= 1.35 ug/ml	DNDI: Cytotoxicity against L929 mouse fibroblasts, 72 hour.	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Mus musculus	ChEMBL23
Trypanosoma brucei	ChEMBL23
Trypanosoma brucei gambiense

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: CHEMBL1860089

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1043711