TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 373.446 | Formula: C20H27N3O4
H donors: 0 H acceptors: 1 LogP: 1.32 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCN(CC1)CCOc1ccc2c(c1)oc(cc2=O)N1CCOCC1
InChi: 1S/C20H27N3O4/c1-21-4-6-22(7-5-21)8-13-26-16-2-3-17-18(24)15-20(27-19(17)14-16)23-9-11-25-12-10-23/h2-3,14-15H,4-13H2,1H3
InChiKey: PSAHDTPFYWULQN-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	sodium:myo inositol cotransporter	0.0041	0.018	0.018
Schistosoma mansoni	acetylcholinesterase	0.0035	0.0139	0.0139
Schistosoma mansoni	inositol transporter	0.0041	0.018	0.018
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0024	0.0024
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0042	0.0187	0.0187
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Echinococcus granulosus	epidermal growth factor receptor	0.0123	0.0739	0.0739
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0064	0.0064
Brugia malayi	hypothetical protein	0.0025	0.0075	0.0075
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0024	0.1262
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0271	0.174	0.174
Schistosoma mansoni	hypothetical protein	0.0252	0.1612	0.1612
Loa Loa (eye worm)	oxidoreductase	0.0128	0.077	0.077
Entamoeba histolytica	aldose reductase, putative	0.0128	0.077	0.6196
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0042	0.0187	0.2428
Trypanosoma brucei	CMGC/DYRK protein kinase, putative	0.0194	0.1217	1
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Echinococcus granulosus	high affinity choline transporter 1	0.037	0.2413	0.2413
Toxoplasma gondii	oxidoreductase, aldo/keto reductase family protein	0.0037	0.0154	0.1999
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Brugia malayi	Protein kinase domain containing protein	0.0271	0.174	0.174
Loa Loa (eye worm)	carboxylesterase	0.0035	0.0139	0.0139
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0064	0.053
Wolbachia endosymbiont of Brugia malayi	NAD-dependent DNA ligase, Lig	0.002	0.0041	0.5
Entamoeba histolytica	aldose reductase, putative	0.0128	0.077	0.6196
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Onchocerca volvulus		0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Echinococcus multilocularis	aldo keto reductase	0.0128	0.077	0.077
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.1488	1	1
Plasmodium vivax	aldehyde reductase, putative	0.0037	0.0154	0.8234
Plasmodium vivax	oxidoreductase, aldo/keto reductase domain containing protein	0.0037	0.0154	0.8234
Onchocerca volvulus		0.0037	0.0154	0.0154
Brugia malayi	Carboxylesterase family protein	0.0035	0.0139	0.0139
Loa Loa (eye worm)	ShTK domain-containing protein	0.0092	0.053	0.053
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0042	0.0187	0.0187
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Schistosoma mansoni	inositol transporter	0.0041	0.018	0.018
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Echinococcus multilocularis	sodium coupled monocarboxylate transporter 1	0.0041	0.018	0.018
Trypanosoma cruzi	aldo-keto reductase	0.0128	0.077	0.6196
Echinococcus granulosus	dual specificity	0.0194	0.1217	0.1217
Echinococcus multilocularis	neuroligin	0.0035	0.0139	0.0139
Toxoplasma gondii	aldo/keto reductase family oxidoreductase	0.0037	0.0154	0.1999
Schistosoma mansoni	amine oxidase	0.0042	0.0187	0.0187
Schistosoma mansoni	BC026374 protein (S09 family)	0.0035	0.0139	0.0139
Loa Loa (eye worm)	TK/INSR protein kinase	0.0271	0.174	0.174
Leishmania major	aldehyde reductase, putative,oxidoreductase, putative	0.0128	0.077	0.6324
Echinococcus multilocularis	aldo keto reductase	0.0128	0.077	0.077
Brugia malayi	Carboxylesterase family protein	0.0035	0.0139	0.0139
Brugia malayi	NADH-dependent xylose reductase	0.0037	0.0154	0.0154
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.0128	0.077	1
Leishmania major	aldo-keto reductase-like protein	0.0128	0.077	0.6324
Onchocerca volvulus		0.0128	0.077	0.077
Loa Loa (eye worm)	oxidoreductase	0.0128	0.077	0.077
Onchocerca volvulus		0.0092	0.053	0.053
Echinococcus granulosus	aldehyde reductase	0.0091	0.0519	0.0519
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0075	0.3994
Mycobacterium tuberculosis	Arylamine N-acetyltransferase Nat (arylamine acetylase)	0.0612	0.4056	1
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0594	0.3937	0.9705
Loa Loa (eye worm)	oxidoreductase	0.0128	0.077	0.077
Schistosoma mansoni	pol-related	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0184	0.1149	0.1149
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Brugia malayi	hypothetical protein	0.0016	0.0014	0.0014
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0064	0.0101
Echinococcus multilocularis	aldehyde reductase	0.0091	0.0519	0.0519
Echinococcus granulosus	sodium coupled monocarboxylate transporter 1	0.0041	0.018	0.018
Mycobacterium ulcerans	arylamine N-acetyltransferase Nat	0.0612	0.4056	1
Loa Loa (eye worm)	oxidoreductase	0.0128	0.077	0.077
Brugia malayi	Uncharacterized hematopoietic stem/progenitor cells protein MDS029	0.0101	0.0588	0.0588
Echinococcus granulosus	nibrin	0.002	0.0041	0.0041
Loa Loa (eye worm)	acetylcholinesterase 1	0.0206	0.13	0.13
Entamoeba histolytica	aldose reductase, putative	0.0128	0.077	0.6196
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0042	0.0187	1
Entamoeba histolytica	protein kinase, putative	0.0194	0.1217	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0128	0.077	0.077
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Brugia malayi	hypothetical protein	0.0035	0.0139	0.0139
Trypanosoma brucei	prostaglandin f synthase	0.0128	0.077	0.6196
Onchocerca volvulus		0.0035	0.0139	0.0139
Plasmodium vivax	hypothetical protein, conserved	0.0042	0.0187	1
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0075	0.097
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0064	0.0064
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0064	0.0064
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0128	0.077	0.077
Onchocerca volvulus		0.002	0.0041	0.0041
Brugia malayi	GH02984p	0.037	0.2413	0.2413
Schistosoma mansoni	chromosome transmission fidelity factor	0.002	0.0041	0.0041
Echinococcus granulosus	BC026374 protein S09 family	0.0035	0.0139	0.0139
Leishmania major	hypothetical protein, conserved	0.0025	0.0075	0.0613
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0139	0.0139
Schistosoma mansoni	tyrosine kinase	0.0271	0.174	0.174
Echinococcus multilocularis	aldo keto reductase	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0041	0.018	0.018
Mycobacterium ulcerans	hypothetical protein	0.0225	0.1427	0.3481
Echinococcus granulosus	aldo keto reductase	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Echinococcus granulosus	para nitrobenzyl esterase	0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0024	0.0024
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.1488	1	1
Brugia malayi	Common central domain of tyrosinase family protein	0.0092	0.053	0.053
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0042	0.0187	0.124
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0064	0.0064
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0035	0.0139	0.0302
Leishmania major	serine/threonine-protein kinase, putative,protein kinase, putative	0.0194	0.1217	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Echinococcus granulosus	replication factor c subunit 1	0.002	0.0041	0.0041
Onchocerca volvulus		0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Brugia malayi	hypothetical protein	0.0042	0.0187	0.0187
Onchocerca volvulus		0.0128	0.077	0.077
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.002	0.0041	0.0533
Brugia malayi	hypothetical protein	0.002	0.0041	0.0041
Echinococcus granulosus	epidermal growth factor receptor	0.0123	0.0739	0.0739
Schistosoma mansoni	potassium channel beta	0.0037	0.0154	0.0154
Trichomonas vaginalis	spcc417.12 protein, putative	0.0035	0.0139	0.1343
Toxoplasma gondii	histone lysine-specific demethylase	0.0042	0.0187	0.2428
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0139	0.0302
Mycobacterium leprae	PROBABLE OXIDOREDUCTASE	0.0128	0.077	1
Schistosoma mansoni	topbp1	0.002	0.0041	0.0041
Echinococcus multilocularis	nibrin	0.002	0.0041	0.0041
Brugia malayi	DnaJ domain containing protein	0.0062	0.032	0.032
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Plasmodium falciparum	protoporphyrinogen oxidase	0.0042	0.0187	1
Chlamydia trachomatis	protoporphyrinogen oxidase	0.0042	0.0187	1
Plasmodium vivax	hypothetical protein, conserved	0.0042	0.0187	1
Trypanosoma brucei	aldo-keto reductase, putative	0.0128	0.077	0.6196
Schistosoma mansoni	tyrosinase precursor	0.0092	0.053	0.053
Loa Loa (eye worm)	hypothetical protein	0.0206	0.13	0.13
Onchocerca volvulus		0.0128	0.077	0.077
Echinococcus multilocularis	epidermal growth factor receptor	0.0123	0.0739	0.0739
Echinococcus multilocularis	insulin receptor	0.0271	0.174	0.174
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0064	0.0101
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0206	0.13	0.13
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0064	0.0064
Echinococcus multilocularis	cdgsh iron sulfur domain containing protein	0.0238	0.1515	0.1515
Brugia malayi	Carboxylesterase family protein	0.0035	0.0139	0.0139
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0024	0.1262
Echinococcus granulosus	sodium:glucose cotransporter	0.0041	0.018	0.018
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0064	0.0101
Echinococcus granulosus	solute carrier family 5	0.0041	0.018	0.018
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0042	0.0187	0.0187
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0064	0.0321
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0128	0.077	1
Schistosoma mansoni	gliotactin	0.0035	0.0139	0.0139
Brugia malayi	amine oxidase, flavin-containing family protein	0.0042	0.0187	0.0187
Entamoeba histolytica	alcohol dehydrogenase, putative	0.0037	0.0154	0.096
Leishmania major	UDP-galactopyranose mutase	0.0042	0.0187	0.1536
Brugia malayi	ATP dependent DNA ligase C terminal region family protein	0.002	0.0041	0.0041
Echinococcus multilocularis	dual specificity	0.0194	0.1217	0.1217
Echinococcus multilocularis	solute carrier family 5	0.0041	0.018	0.018
Trichomonas vaginalis	alcohol dehydrogenase, putative	0.0037	0.0154	0.1549
Trypanosoma cruzi	aldo/keto reductase, putative	0.0128	0.077	0.6196
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0194	0.1217	1
Trichomonas vaginalis	aldo/keto reductase, putative	0.0128	0.077	1
Loa Loa (eye worm)	oxidoreductase	0.0128	0.077	0.077
Trichomonas vaginalis	conserved hypothetical protein	0.0037	0.0154	0.1549
Echinococcus granulosus	acetylcholinesterase	0.0206	0.13	0.13
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0064	0.0199
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0075	0.0075
Plasmodium falciparum	aldehyde reductase, putative	0.0037	0.0154	0.8234
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Echinococcus multilocularis	aldo keto reductase	0.0128	0.077	0.077
Echinococcus multilocularis	sodium:glucose cotransporter 2	0.0041	0.018	0.018
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Echinococcus multilocularis	dnaJ subfamily C 6	0.0062	0.032	0.032
Echinococcus multilocularis	replication factor c subunit 1	0.002	0.0041	0.0041
Echinococcus granulosus	acetylcholinesterase	0.0206	0.13	0.13
Echinococcus multilocularis	voltage gated potassium channel subunit	0.0037	0.0154	0.0154
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0064	0.0117
Trypanosoma cruzi	CMGC/DYRK protein kinase, putative	0.0194	0.1217	1
Mycobacterium ulcerans	monoamine oxidase	0.0042	0.0187	0.0405
Mycobacterium ulcerans	NAD-dependent DNA ligase LigA	0.002	0.0041	0.0043
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0042	0.0187	0.0405
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0139	0.0139
Brugia malayi	Protein kinase domain containing protein	0.0194	0.1217	0.1217
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0042	0.0187	1
Schistosoma mansoni	serine/threonine protein kinase	0.1488	1	1
Schistosoma mansoni	aldo-keto reductase	0.0128	0.077	0.077
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0206	0.13	0.13
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Mycobacterium ulcerans	carboxylesterase, LipT	0.0035	0.0139	0.0286
Onchocerca volvulus		0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0024	0.0024
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0128	0.077	1
Loa Loa (eye worm)	hypothetical protein	0.0184	0.1149	0.1149
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.1488	1	1
Schistosoma mansoni	tyrosine kinase	0.0271	0.174	0.174
Onchocerca volvulus		0.0101	0.0588	0.0588
Echinococcus granulosus	hypothetical protein	0.0128	0.077	0.077
Trichomonas vaginalis	dihydrodiol dehydrogenase, putative	0.0128	0.077	1
Loa Loa (eye worm)	ShTK domain-containing protein	0.0092	0.053	0.053
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Mycobacterium ulcerans	oxidoreductase	0.0128	0.077	0.185
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0588	0.0588
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0042	0.0187	1
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0064	0.0199
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Trypanosoma cruzi	aldo/keto reductase, putative	0.0037	0.0154	0.096
Brugia malayi	Protein kinase domain containing protein	0.015	0.0919	0.0919
Brugia malayi	Carboxylesterase family protein	0.0035	0.0139	0.0139
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0035	0.0139	0.0139
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Toxoplasma gondii	aldo-keto reductase	0.0037	0.0154	0.1999
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0075	0.0286
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0042	0.0187	0.124
Schistosoma mansoni	high-affinity choline transporter	0.037	0.2413	0.2413
Brugia malayi	Hypothetical tyrosinase-like protein F21C3.2 in chromosome I	0.0092	0.053	0.053
Onchocerca volvulus		0.0092	0.053	0.053
Schistosoma mansoni	sodium/solute symporter	0.0041	0.018	0.018
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0064	0.0064
Onchocerca volvulus		0.0035	0.0139	0.0139
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0035	0.0139	0.1343
Loa Loa (eye worm)	glutamate-cysteine ligase modifier subunit	0.0037	0.0154	0.0154
Brugia malayi	Hypothetical tyrosinase-like protein C02C2.1 in chromosome III	0.0092	0.053	0.053
Brugia malayi	Sodium:solute symporter family protein	0.0041	0.018	0.018
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0064	0.0101
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0128	0.077	0.077
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0064	0.0117
Onchocerca volvulus		0.0092	0.053	0.053
Plasmodium falciparum	replication factor C subunit 1, putative	0.002	0.0041	0.2195
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Trypanosoma brucei	aldo/keto reductase, putative	0.0037	0.0154	0.096
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0024	0.0024
Echinococcus multilocularis		0.0042	0.0187	0.0187
Loa Loa (eye worm)	DnaJ domain-containing protein	0.0062	0.032	0.032
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0075	0.3994
Schistosoma mansoni	hypothetical protein	0.0062	0.032	0.032
Schistosoma mansoni	DNA ligase IV	0.002	0.0041	0.0041
Loa Loa (eye worm)	carboxylesterase	0.0035	0.0139	0.0139
Entamoeba histolytica	protein kinase, putative	0.0194	0.1217	1
Schistosoma mansoni	tyrosine kinase	0.0121	0.0724	0.0724
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0552	0.3653	0.9002
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0075	0.0286
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0064	0.0199
Onchocerca volvulus		0.0035	0.0139	0.0139
Echinococcus granulosus	dnaJ subfamily C 6	0.0062	0.032	0.032
Brugia malayi	Carboxylesterase family protein	0.0206	0.13	0.13
Leishmania major	aldo/keto reductase, putative,aldo/keto reductase family-like protein	0.0037	0.0154	0.1265
Onchocerca volvulus		0.0042	0.0187	0.0187
Brugia malayi	DKFZp564C0469 protein	0.002	0.0041	0.0041
Mycobacterium tuberculosis	Probable oxidoreductase	0.0128	0.077	0.1864
Echinococcus multilocularis	sodium:myo inositol cotransporter	0.0041	0.018	0.018
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0271	0.174	0.174
Trichomonas vaginalis	aldo-keto reductase, putative	0.0037	0.0154	0.1549
Echinococcus multilocularis	acetylcholinesterase	0.0206	0.13	0.13
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0075	0.3994
Trichomonas vaginalis	aldo-keto reductase, putative	0.0037	0.0154	0.1549
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0064	0.0101
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0154	0.0339
Leishmania major	prostaglandin f2-alpha synthase/D-arabinose dehydrogenase	0.0128	0.077	0.6324
Echinococcus granulosus	cdgsh iron sulfur domain containing protein	0.0238	0.1515	0.1515
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0064	0.053
Echinococcus multilocularis	high affinity choline transporter 1	0.037	0.2413	0.2413
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Brugia malayi	glutamate-cysteine ligase modifier subunit	0.0037	0.0154	0.0154
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0035	0.0139	0.0139
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0154	0.0323
Schistosoma mansoni	amine oxidase	0.0042	0.0187	0.0187
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Giardia lamblia	Aldose reductase	0.0128	0.077	1
Trichomonas vaginalis	protein kinase inhibitor, putative	0.0062	0.032	0.3834
Plasmodium vivax	replication factor C subunit 1, putative	0.002	0.0041	0.2195
Echinococcus granulosus	aldo keto reductase	0.0128	0.077	0.077
Mycobacterium ulcerans	oxidoreductase	0.0042	0.0187	0.0405
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0024	0.0016
Echinococcus granulosus	aldo keto reductase family 1, member B4	0.0037	0.0154	0.0154
Echinococcus granulosus	neuroligin	0.0035	0.0139	0.0139
Echinococcus multilocularis		0.0035	0.0143	0.0143
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0139	0.0302
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0042	0.0187	0.0187
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0123	0.0739	0.0739
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.1488	1	1
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0064	0.0101
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0035	0.0139	0.0139
Brugia malayi	Hypothetical tyrosinase-like protein C02C2.1 in chromosome III	0.0092	0.053	0.053
Echinococcus multilocularis	epidermal growth factor receptor	0.0123	0.0739	0.0739
Schistosoma mansoni	tyrosine kinase	0.0121	0.0724	0.0724
Mycobacterium tuberculosis	Possible oxidoreductase	0.0042	0.0187	0.0421
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0042	0.0187	0.0187
Schistosoma mansoni	serine/threonine protein kinase	0.0194	0.1217	0.1217
Leishmania major	prostaglandin f synthase, putative	0.0128	0.077	0.6324
Schistosoma mansoni	tyrosinase precursor	0.0092	0.053	0.053
Entamoeba histolytica	alcohol dehydrogenase, putative	0.0037	0.0154	0.096
Brugia malayi	Pax transcription activation domain interacting protein	0.002	0.0041	0.0041
Onchocerca volvulus		0.0092	0.053	0.053
Schistosoma mansoni	aldo-keto reductase	0.0128	0.077	0.077
Mycobacterium leprae	Possible oxidoreductase	0.0037	0.0154	0.1549
Schistosoma mansoni	tyrosine kinase	0.0123	0.0739	0.0739
Giardia lamblia	Aldose reductase	0.0128	0.077	1
Onchocerca volvulus		0.0024	0.0064	0.0064
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Loa Loa (eye worm)	hypothetical protein	0.0092	0.053	0.053
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0064	0.0321
Toxoplasma gondii	aldose reductase, putative	0.0128	0.077	1
Brugia malayi	oxidoreductase, aldo/keto reductase family protein	0.0128	0.077	0.077
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0042	0.0187	0.0187
Chlamydia trachomatis	DNA ligase	0.002	0.0041	0.1069
Echinococcus multilocularis	carboxylesterase 5A	0.0206	0.13	0.13
Loa Loa (eye worm)	CMGC/DYRK/DYRK1 protein kinase	0.0194	0.1217	0.1217
Brugia malayi	Hypothetical tyrosinase-like protein C02C2.1 in chromosome III	0.0092	0.053	0.053
Loa Loa (eye worm)	hypothetical protein	0.0092	0.053	0.053
Mycobacterium ulcerans	dehydrogenase	0.0042	0.0187	0.0405
Brugia malayi	hypothetical protein	0.002	0.0041	0.0041
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Loa Loa (eye worm)	hypothetical protein	0.037	0.2413	0.2413
Brugia malayi	SWIRM domain containing protein	0.0042	0.0187	0.0187
Echinococcus multilocularis	acetylcholinesterase	0.0206	0.13	0.13
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0139	0.0139
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Echinococcus granulosus	sodium:glucose cotransporter 2	0.0041	0.018	0.018
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Plasmodium falciparum	aldo-keto reductase, putative	0.0037	0.0154	0.8234
Echinococcus granulosus	aldo keto reductase	0.0128	0.077	0.077
Echinococcus granulosus	voltage gated potassium channel subunit	0.0037	0.0154	0.0154
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Brugia malayi	Furin-like cysteine rich region family protein	0.0123	0.0739	0.0739
Schistosoma mansoni	topbp1	0.002	0.0041	0.0041
Loa Loa (eye worm)	carboxylesterase	0.0206	0.13	0.13
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0187	0.0187
Brugia malayi	topoisomerase	0.002	0.0041	0.0041
Onchocerca volvulus		0.0041	0.018	0.018
Schistosoma mansoni	tyrosine kinase	0.0123	0.0739	0.0739
Echinococcus granulosus	aldo keto reductase family 1 member B4	0.0128	0.077	0.077
Trichomonas vaginalis	aldo/keto reductase, putative	0.0128	0.077	1
Onchocerca volvulus		0.0128	0.077	0.077
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Echinococcus multilocularis	aldo keto reductase family 1, member B4	0.0128	0.077	0.077
Treponema pallidum	DNA ligase (lig)	0.002	0.0041	0.5
Loa Loa (eye worm)	hypothetical protein	0.0148	0.0905	0.0905
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0042	0.0187	0.2002
Echinococcus granulosus	insulin receptor	0.0271	0.174	0.174
Schistosoma mansoni	CDGSH-type Zn finger-containing protein-like protein	0.0252	0.1612	0.1612
Brugia malayi	ShTK domain containing protein	0.0092	0.053	0.053
Entamoeba histolytica	protein kinase domain containing protein	0.0194	0.1217	1
Toxoplasma gondii	transporter, solute:sodium symporter (SSS) family protein	0.0041	0.018	0.2335
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0064	0.0101
Onchocerca volvulus		0.0128	0.077	0.077
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0075	0.0286
Schistosoma mansoni	tyrosine kinase	0.0123	0.0739	0.0739
Entamoeba histolytica	hypothetical protein	0.0194	0.1217	1
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.1488	1	1
Loa Loa (eye worm)	tyrosinase 1	0.0092	0.053	0.053
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0594	0.3937	0.9705
Echinococcus multilocularis	para nitrobenzyl esterase	0.0035	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0024	0.0024
Trichomonas vaginalis	aldo-keto reductase, putative	0.0128	0.077	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0041	0.0041
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0042	0.0187	0.0421
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0064	0.053
Trichomonas vaginalis	aldo-keto reductase, putative	0.0037	0.0154	0.1549
Mycobacterium leprae	Conserved hypothetical protein	0.0091	0.0519	0.6554
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.1488	1	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0123	0.0739	0.0739
Brugia malayi	Carboxylesterase family protein	0.0206	0.13	0.13
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0064	0.0101
Schistosoma mansoni	tyrosine kinase	0.0121	0.0724	0.0724
Echinococcus granulosus	carboxylesterase 5A	0.0206	0.13	0.13
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0042	0.0187	1
Toxoplasma gondii	ATPase, AAA family protein	0.002	0.0041	0.0533

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 35 uM	In vitro inhibitory activity against ADP-induced human platelet aggregation	ChEMBL.	8336341
IC50 (functional)	= 35 uM	In vitro inhibitory activity against ADP-induced human platelet aggregation	ChEMBL.	8336341

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 102990