TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 606.711 | Formula: C36H38N4O5
H donors: 3 H acceptors: 5 LogP: 5.79 Rotable bonds: 12
Rule of 5 violations (Lipinski): 2
SMILES: CCOc1cc(ccc1/C=C/C(=O)O)NC(=O)C1(CCC1)NC(=O)c1ccc2c(c1)n(C)c(c2C1CCCC1)c1ccccn1
InChi: 1S/C36H38N4O5/c1-3-45-30-22-26(15-12-23(30)14-17-31(41)42)38-35(44)36(18-8-19-36)39-34(43)25-13-16-27-29(21-25)40(2)33(28-11-6-7-20-37-28)32(27)24-9-4-5-10-24/h6-7,11-17,20-22,24H,3-5,8-10,18-19H2,1-2H3,(H,38,44)(H,39,43)(H,41,42)/b17-14+
InChiKey: LZEKYTNIRIGABP-SAPNQHFASA-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
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0089	0.0269	0.0256
Echinococcus granulosus	acetylcholinesterase	0.2591	1	1
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Echinococcus granulosus	nAChR subunit	0.0182	0.0633	0.062
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0044	0.0031
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0048	0.028
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0182	0.0633	0.062
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0438	0.1627	1
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Brugia malayi	aspartic protease BmAsp-2, identical	0.0034	0.0058	0.0045
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Brugia malayi	aspartic protease BmAsp-1, identical	0.0034	0.0058	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0058	0.0045
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0048	0.028
Onchocerca volvulus		0.0438	0.1627	1
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0031	0.0046	0.032
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Loa Loa (eye worm)	ACC-1 protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Plasmodium falciparum	protein kinase 7	0.0289	0.1047	0.6471
Plasmodium vivax	hexose transporter	0.0102	0.0322	0.1542
Toxoplasma gondii	aspartyl protease ASP3	0.0034	0.0058	0.0433
Trichomonas vaginalis	conserved hypothetical protein	0.0102	0.0322	0.1966
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0022	0.0008
Plasmodium vivax	proline--tRNA ligase, putative	0.0036	0.0064	0.0251
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Echinococcus granulosus	calcium dependent protein kinase	0.0029	0.0039	0.0025
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0182	0.0633	0.062
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0093	0.0288	0.0275
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0064	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0182	0.0633	0.062
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0048	0.6871
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0182	0.0633	0.062
Plasmodium falciparum	plasmepsin I	0.0034	0.0058	0.028
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Brugia malayi	hypothetical protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0064	1
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0438	0.1627	0.1616
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0044	0.0031
Echinococcus multilocularis	neuroligin	0.0438	0.1627	0.1616
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0182	0.0633	0.062
Brugia malayi	Sugar transporter family protein	0.0102	0.0322	0.0309
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0089	0.0269	0.0256
Brugia malayi	Carboxylesterase family protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.2591	1	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0058	0.0045
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0438	0.1627	0.1616
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0182	0.0633	0.062
Plasmodium vivax	aspartyl protease, putative	0.0034	0.0058	0.0224
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0089	0.0269	0.0256
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0102	0.0322	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0666	0.2516	0.2506
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0044	0.0031
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0182	0.0633	0.062
Schistosoma mansoni	acetylcholine receptor-related	0.0089	0.0269	0.0256
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0031	0.0046	0.0165
Echinococcus granulosus	cathepsin d lysosomal aspartyl protease	0.0034	0.0058	0.0045
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0182	0.0633	0.062
Onchocerca volvulus		0.0438	0.1627	1
Brugia malayi	hypothetical protein	0.0089	0.0269	0.0256
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0089	0.0269	0.0256
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0438	0.1627	0.1616
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0031	0.0044	0.111
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Brugia malayi	Carboxylesterase family protein	0.0438	0.1627	0.1616
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0031	0.0046	0.0033
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0044	0.0031
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Echinococcus multilocularis	carboxylesterase 5A	0.2591	1	1
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0433	0.161	0.7981
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0182	0.0633	0.062
Echinococcus granulosus	glycine receptor subunit beta	0.0182	0.0633	0.062
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0031	0.0046	0.0207
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0173	0.016
Echinococcus granulosus	neuroligin	0.0438	0.1627	0.1616
Schistosoma mansoni	glucose transport protein	0.0102	0.0322	0.0309
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0182	0.0633	0.062
Schistosoma mansoni	glucose transport protein	0.0102	0.0322	0.0309
Trichomonas vaginalis	spcc417.12 protein, putative	0.0438	0.1627	1
Plasmodium vivax	aspartyl proteinase, putative	0.0034	0.0058	0.0224
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0093	0.0288	0.0275
Leishmania major	glucose transporter, lmgt3	0.0032	0.0048	0.6871
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0089	0.0269	0.0256
Echinococcus multilocularis	cathepsin d (lysosomal aspartyl protease)	0.0034	0.0058	0.0045
Plasmodium falciparum	plasmepsin VII	0.0034	0.0058	0.028
Loa Loa (eye worm)	hypothetical protein	0.0238	0.0849	0.0837
Schistosoma mansoni	protein kinase	0.0031	0.0046	0.0033
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Toxoplasma gondii	eukaryotic aspartyl protease superfamily protein	0.0034	0.0058	0.0433
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0182	0.0633	0.062
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0064	1
Loa Loa (eye worm)	aspartic protease BmAsp-1	0.0034	0.0058	0.0045
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0031	0.0046	0.0207
Schistosoma mansoni	neurotransmitter gated ion channel	0.0089	0.0269	0.0256
Onchocerca volvulus		0.0089	0.0269	0.1346
Brugia malayi	Pepsin A precursor	0.0034	0.0058	0.0045
Loa Loa (eye worm)	GABA receptor subunit	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Onchocerca volvulus	Putative nachr subunit	0.0182	0.0633	0.3662
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0438	0.1627	0.1616
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0048	0.028
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0089	0.0269	0.0256
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Schistosoma mansoni	neurotransmitter gated ion channel	0.0089	0.0269	0.0256
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0182	0.0633	0.062
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0064	1
Loa Loa (eye worm)	hypothetical protein	0.2591	1	1
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0044	0.0031
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0182	0.0633	0.062
Plasmodium falciparum	plasmepsin V	0.0034	0.0058	0.028
Echinococcus multilocularis	General substrate transporter	0.0088	0.0266	0.0253
Leishmania major	glucose transporter, lmgt1	0.0032	0.0048	0.6871
Onchocerca volvulus		0.0182	0.0633	0.3662
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Trichomonas vaginalis	Clan AA, family A1, cathepsin D-like aspartic peptidase	0.0034	0.0058	0.0343
Brugia malayi	Carboxylesterase family protein	0.2591	1	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0089	0.0269	0.0256
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0182	0.0633	0.062
Brugia malayi	Cation transporter family protein	0.0182	0.0633	0.062
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0093	0.0288	0.0275
Schistosoma mansoni	acetylcholinesterase	0.0438	0.1627	0.1616
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0792	0.3004	0.2995
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0048	0.6871
Onchocerca volvulus		0.0093	0.0288	0.1466
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0048	0.6871
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0422	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0182	0.0633	0.062
Loa Loa (eye worm)	carboxylesterase	0.0438	0.1627	0.1616
Echinococcus granulosus	acetylcholinesterase	0.2591	1	1
Brugia malayi	Carboxylesterase family protein	0.0438	0.1627	0.1616
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0165	0.0566	0.5352
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0089	0.0269	0.0256
Schistosoma mansoni	alzheimer's disease beta-amyloid related	0.011	0.0353	0.034
Brugia malayi	Cation transporter family protein	0.0182	0.0633	0.062
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Loa Loa (eye worm)	aspartic protease BmAsp-2	0.0034	0.0058	0.0045
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0182	0.0633	0.062
Onchocerca volvulus		0.0182	0.0633	0.3662
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0182	0.0633	0.062
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0048	0.6871
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.0046	0.0033
Echinococcus granulosus	para nitrobenzyl esterase	0.0438	0.1627	0.1616
Toxoplasma gondii	aspartyl protease	0.0034	0.0058	0.0433
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	ACC-1 protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Plasmodium vivax	plasmepsin V, putative	0.0034	0.0058	0.0224
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Toxoplasma gondii	protein kinase, putative	0.0289	0.1047	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0058	0.0045
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0182	0.0633	0.062
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Echinococcus granulosus	BC026374 protein S09 family	0.0438	0.1627	0.1616
Onchocerca volvulus		0.0182	0.0633	0.3662
Brugia malayi	hypothetical protein	0.0089	0.0269	0.0256
Schistosoma mansoni	nAChR subunit	0.0089	0.0269	0.0256
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0182	0.0633	0.062
Plasmodium falciparum	hexose transporter	0.0102	0.0322	0.1932
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0031	0.0046	0.0165
Toxoplasma gondii	facilitative glucose transporter GT1	0.0102	0.0322	0.2985
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0048	0.6871
Loa Loa (eye worm)	carboxylesterase	0.2591	1	1
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0182	0.0633	0.062
Schistosoma mansoni	glucose transport protein	0.0102	0.0322	0.0309
Loa Loa (eye worm)	sugar transporter	0.0102	0.0322	0.0309
Plasmodium falciparum	plasmepsin II	0.0034	0.0058	0.028
Schistosoma mansoni	hypothetical protein	0.0102	0.0322	0.0309
Onchocerca volvulus		0.0093	0.0288	0.1466
Loa Loa (eye worm)	acetylcholinesterase 1	0.2591	1	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0438	0.1627	1
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Plasmodium vivax	aspartyl protease, putative	0.0034	0.0058	0.0224
Echinococcus granulosus	General substrate transporter	0.0088	0.0266	0.0253
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0013	0.3046
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Echinococcus multilocularis	glycine receptor subunit beta	0.0182	0.0633	0.062
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Schistosoma mansoni	BC026374 protein (S09 family)	0.0438	0.1627	0.1616
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0089	0.0269	0.0256
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0031	0.0046	0.0207
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0031	0.0046	0.0033
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0182	0.0633	0.062
Entamoeba histolytica	hypothetical protein	0.0093	0.0288	1
Plasmodium falciparum	plasmepsin IX	0.0034	0.0058	0.028
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0048	0.028
Echinococcus multilocularis	nAChR subunit	0.0093	0.0288	0.0275
Plasmodium falciparum	plasmepsin X	0.0034	0.0058	0.028
Brugia malayi	hypothetical protein	0.0089	0.0269	0.0256
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0048	0.6871
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.2591	1	1
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0031	0.0046	0.0207
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0182	0.0633	0.062
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0182	0.0633	0.062
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0048	0.028
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0182	0.0633	0.062
Entamoeba histolytica	protein kinase, putative	0.0031	0.0046	0.12
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0036	0.0064	0.0486
Brugia malayi	Cation transporter family protein	0.0182	0.0633	0.062
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Brugia malayi	hypothetical protein	0.0089	0.0269	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Echinococcus multilocularis	glycine receptor subunit beta	0.0182	0.0633	0.062
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0031	0.0046	0.0033
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0438	0.1627	0.1616
Onchocerca volvulus		0.0438	0.1627	1
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Plasmodium falciparum	plasmepsin III	0.0034	0.0058	0.028
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Schistosoma mansoni	nAChR subunit	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0438	0.1627	0.1616
Echinococcus multilocularis	acetylcholinesterase	0.2591	1	1
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0031	0.0046	0.0165
Schistosoma mansoni	protein kinase	0.0031	0.0046	0.0033
Plasmodium falciparum	plasmepsin VI	0.0034	0.0058	0.028
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0182	0.0633	0.062
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0089	0.0269	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0578	0.2171	0.2161
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0031	0.0046	0.0165
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0438	0.1627	1
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0182	0.0633	0.062
Trichomonas vaginalis	CAMK family protein kinase	0.0031	0.0046	0.027
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0093	0.0288	0.0275
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Onchocerca volvulus		0.0089	0.0269	0.1346
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0048	0.028
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0182	0.0633	0.062
Plasmodium vivax	aspartyl protease, putative	0.0034	0.0058	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0048	0.028
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0031	0.0044	0.0031
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0089	0.0269	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Schistosoma mansoni	protein kinase	0.0031	0.0046	0.0033
Echinococcus multilocularis	calcium dependent protein kinase	0.0029	0.0039	0.0025
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0034	0.0058	0.0045
Schistosoma mansoni	cathepsin D (A01 family)	0.0034	0.0058	0.0045
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0438	0.1627	1
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0182	0.0633	0.062
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Schistosoma mansoni	memapsin-2 (A01 family)	0.0854	0.3247	0.3238
Schistosoma mansoni	neurotransmitter gated ion channel	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0182	0.0633	0.062
Brugia malayi	hypothetical protein	0.0034	0.0058	0.0045
Onchocerca volvulus		0.0182	0.0633	0.3662
Brugia malayi	hypothetical protein	0.0034	0.0058	0.0045
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0044	0.0031
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0031	0.0044	0.0031
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Plasmodium falciparum	plasmepsin IV	0.0034	0.0058	0.028
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0031	0.0046	0.6561
Echinococcus granulosus	glycine receptor subunit beta	0.0182	0.0633	0.062
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0182	0.0633	0.062
Brugia malayi	hypothetical protein	0.0089	0.0269	0.0256
Brugia malayi	Amyloid A4 extracellular domain containing protein	0.0302	0.1098	0.1086
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0089	0.0269	0.0256
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0031	0.0046	0.032
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0182	0.0633	0.062
Brugia malayi	excitatory GABA receptor EXP-1A	0.0182	0.0633	0.062
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0048	0.6871
Entamoeba histolytica	protein kinase, putative	0.0031	0.0046	0.12
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0031	0.0046	0.0033
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0089	0.0269	0.0256
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0048	0.6871
Schistosoma mansoni	cathepsin D (A01 family)	0.0034	0.0058	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0165	0.0566	0.2764
Echinococcus multilocularis	para nitrobenzyl esterase	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0031	0.0046	0.032
Brugia malayi	Cam kinase protein 1	0.0031	0.0046	0.0033
Brugia malayi	Carboxylesterase family protein	0.0438	0.1627	0.1616
Loa Loa (eye worm)	LGC-31 protein	0.0182	0.0633	0.062
Leishmania major	glucose transporter, lmgt2	0.0032	0.0048	0.6871
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0048	0.6871
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0013	0.5
Echinococcus multilocularis	nAChR subunit	0.0182	0.0633	0.062
Schistosoma mansoni	gliotactin	0.0438	0.1627	0.1616
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0089	0.0269	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0046	0.0033
Plasmodium falciparum	proline--tRNA ligase	0.0036	0.0064	0.0315
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0182	0.0633	0.062
Loa Loa (eye worm)	acetylcholine receptor protein	0.0089	0.0269	0.0256
Mycobacterium ulcerans	carboxylesterase, LipT	0.0438	0.1627	1
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0031	0.0044	0.0255
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Trypanosoma cruzi	hexose transporter	0.0032	0.0048	0.6871
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Onchocerca volvulus		0.0182	0.0633	0.3662
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0048	0.6871
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0031	0.0044	1
Loa Loa (eye worm)	carboxylesterase	0.0438	0.1627	0.1616
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Loa Loa (eye worm)	hypothetical protein	0.0438	0.1627	0.1616
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0046	0.0033
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0288	0.0275
Echinococcus granulosus	nAChR subunit	0.0093	0.0288	0.0275
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Toxoplasma gondii	aspartyl protease ASP1	0.0034	0.0058	0.0433
Plasmodium vivax	plasmepsin IV, putative	0.0034	0.0058	0.0224
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0031	0.0046	0.0207
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0064	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0182	0.0633	0.062
Plasmodium falciparum	protein kinase 6	0.0433	0.161	1
Toxoplasma gondii	aspartyl proteinase (eimepsin), putative	0.0034	0.0058	0.0433
Brugia malayi	Eukaryotic aspartyl protease family protein	0.0034	0.0058	0.0045
Leishmania major	protein kinase, putative	0.0031	0.0046	0.6561
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0013	0.0067
Onchocerca volvulus		0.0089	0.0269	0.1346
Plasmodium vivax	tryptophan-rich antigen (Pv-fam-a)	0.0537	0.2014	1
Echinococcus granulosus	carboxylesterase 5A	0.2591	1	1
Onchocerca volvulus		0.0438	0.1627	1
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0093	0.0288	0.0275
Echinococcus multilocularis	acetylcholinesterase	0.2591	1	1
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0165	0.0566	0.3464
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0269	0.0256
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0182	0.0633	0.062
Schistosoma mansoni	nAChR subunit	0.0089	0.0269	0.0256
Plasmodium falciparum	plasmepsin VIII, putative	0.0034	0.0058	0.028
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0182	0.0633	0.062
Onchocerca volvulus		0.0182	0.0633	0.3662
Onchocerca volvulus		0.0438	0.1627	1
Giardia lamblia	Prolyl-tRNA synthetase	0.0031	0.0044	1
Plasmodium vivax	aspartyl proteinase, putative	0.0034	0.0058	0.0224
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0666	0.2516	0.2506
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.0322	0.0309
Loa Loa (eye worm)	aspartyl protease 6	0.0034	0.0058	0.0045
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0438	0.1627	0.1616

Activities

Activity type	Activity value	Assay description	Source	Reference
T1/2 (ADMET)	= 64 min	Half life in human liver microsomes	ChEMBL.	25393851

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: CHEMBL3355213

Bibliographic References

No literature references available for this target.

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Detailed information for compound 943872