TDR Targets

Basic information

Technical information

TDR Targets ID: 290017
Name: methyl 4-[(E)-3-oxo-3-(5,5,8,8-tetramethyl-6, 7-dihydronaphthalen-2-yl)prop-1-enyl]benzoate
MW: 376.488 | Formula: C25H28O3
H donors: 0 H acceptors: 2 LogP: 6.67 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)c1ccc(cc1)/C=C/C(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChi: 1S/C25H28O3/c1-24(2)14-15-25(3,4)21-16-19(11-12-20(21)24)22(26)13-8-17-6-9-18(10-7-17)23(27)28-5/h6-13,16H,14-15H2,1-5H3/b13-8+
InChiKey: QCRZZMHOMKWYLQ-MDWZMJQESA-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

methyl 4-[(E)-3-oxo-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-enyl]benzoate
4-[(E)-3-oxo-3-(1,1,4,4-tetramethyl-6-tetralinyl)prop-1-enyl]benzoic acid methyl ester
4-[(E)-3-keto-3-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-enyl]benzoic acid methyl ester

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)	GTP-binding regulatory protein Gs alpha-S chain	0.0048	0.0106	0.023
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Loa Loa (eye worm)	hypothetical protein	0.0112	0.0319	0.0702
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trichomonas vaginalis	FMN-dependent NADH-azoreductase, putative	0.0343	0.1088	0.1075
Loa Loa (eye worm)	transcription factor SMAD2	0.0124	0.0361	0.0794
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0022	0.0019	0.0369
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0022	0.0019	0.0305
Echinococcus granulosus	glutathione S transferase	0.0043	0.0091	0.1553
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Loa Loa (eye worm)	thioredoxin reductase	0.0063	0.0155	0.0339
Trichomonas vaginalis	glutathione reductase, putative	0.0022	0.0019	0.0005
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0827	0.2697	0.2686
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.0014	0.0214
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Echinococcus multilocularis	glutathione S transferase	0.0188	0.0573	1
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0022	0.0019	1
Trypanosoma brucei	elongation factor 1 gamma, putative	0.0043	0.0091	0.5426
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0106	0.1816
Brugia malayi	MH2 domain containing protein	0.0124	0.0361	0.0797
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.3022	1	1
Echinococcus multilocularis	glutathione S transferase	0.0145	0.043	0.7491
Echinococcus multilocularis	glutathione S transferase	0.0188	0.0573	1
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Brugia malayi	glutathione reductase	0.0063	0.0155	0.0343
Plasmodium falciparum	flap endonuclease 1	0.0027	0.0037	0.0328
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0827	0.2697	0.2686
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.0014	0.0027
Trypanosoma cruzi	DNA polymerase eta, putative	0.0033	0.0056	0.2987
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0063	0.0155	0.2682
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Plasmodium vivax	elongation factor 1-gamma, putative	0.0043	0.0091	0.1287
Trypanosoma brucei	DNA polymerase eta, putative	0.0047	0.0102	0.6255
Schistosoma mansoni	hypothetical protein	0.0036	0.0065	0.1109
Brugia malayi	latrophilin 2 splice variant baaae	0.0036	0.0065	0.0144
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0022	0.0019	0.0369
Loa Loa (eye worm)	MH2 domain-containing protein	0.0124	0.0361	0.0794
Brugia malayi	ImpB/MucB/SamB family protein	0.0047	0.0102	0.0226
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0048	0.0106	0.0233
Plasmodium vivax	glutathione S-transferase, putative	0.0188	0.0573	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0022	0.0019	0.5
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	glutaminyl-tRNA synthetase, putative	0.0145	0.043	0.0417
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0033	0.0056	0.2718
Echinococcus granulosus	dna polymerase kappa	0.002	0.0014	0.0214
Echinococcus granulosus	flap endonuclease 1	0.0027	0.0037	0.0622
Echinococcus multilocularis	transcription factor eb	0.0112	0.0321	0.5586
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Plasmodium vivax	flap endonuclease 1, putative	0.0027	0.0037	0.0328
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0022	0.0019	0.0305
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.0014	0.0214
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Plasmodium falciparum	glutathione reductase	0.0063	0.0155	0.2452
Giardia lamblia	Flap structure-specific endonuclease	0.0027	0.0037	0.0087
Loa Loa (eye worm)	hypothetical protein	0.1377	0.4526	1
Entamoeba histolytica	Flap nuclease, putative	0.0027	0.0037	0.0218
Trypanosoma brucei	elongation factor 1 gamma, putative	0.0043	0.0091	0.5426
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0052	0.012	0.0261
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Echinococcus multilocularis	glutathione s transferase mu	0.0188	0.0573	1
Giardia lamblia	NADPH oxidoreductase, putative	0.0827	0.2697	1
Toxoplasma gondii	thioredoxin reductase	0.0063	0.0155	1
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0027	0.0037	0.1656
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Echinococcus granulosus	glutathione S transferase Mu 1	0.0188	0.0573	1
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0252	0.0554
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0106	0.1816
Echinococcus multilocularis	glutathione S transferase	0.0043	0.0091	0.1553
Trichomonas vaginalis	NAD(P)H dehydrogenase, putative	0.0827	0.2697	0.2686
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0022	0.0019	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0052	0.012	0.0261
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0022	0.0019	1
Plasmodium vivax	thioredoxin reductase, putative	0.0063	0.0155	0.2452
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0027	0.0037	0.1656
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Echinococcus multilocularis	flap endonuclease 1	0.0027	0.0037	0.0622
Toxoplasma gondii	elongation factor 1-gamma, putative	0.0043	0.0091	0.525
Giardia lamblia	NADH oxidase lateral transfer candidate	0.0022	0.0019	0.0019
Echinococcus multilocularis	glutathione S transferase	0.0145	0.043	0.7491
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0022	0.0019	1
Echinococcus granulosus	glutathione S transferase	0.0145	0.043	0.7491
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Entamoeba histolytica	iron-sulfur flavoprotein, putative	0.0343	0.1088	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Brugia malayi	glutathione transferase	0.1377	0.4526	1
Echinococcus multilocularis	prostaglandin H2 D isomerase	0.0188	0.0573	1
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0002	0.0004
Brugia malayi	hypothetical protein	0.0092	0.0252	0.0558
Leishmania major	trypanothione reductase	0.0063	0.0155	1
Trichomonas vaginalis	conserved hypothetical protein	0.0484	0.1556	0.1544
Loa Loa (eye worm)	glutathione reductase	0.0063	0.0155	0.0339
Plasmodium falciparum	thioredoxin reductase	0.0063	0.0155	0.2452
Echinococcus granulosus	glutathione s transferase mu	0.0188	0.0573	1
Leishmania major	hypothetical protein, conserved	0.0043	0.0091	0.5426
Echinococcus granulosus	thioredoxin glutathione reductase	0.0063	0.0155	0.2682
Entamoeba histolytica	modulator of drug activity B homolog, putative	0.0343	0.1088	1
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0252	0.0554
Echinococcus multilocularis	dna polymerase eta	0.0047	0.0102	0.1758
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0027	0.0037	0.1336
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0022	0.0019	0.5
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0022	0.0019	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Trypanosoma cruzi	trypanothione reductase, putative	0.0022	0.0019	0.0369
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0052	0.012	0.0265
Loa Loa (eye worm)	helix-loop-helix DNA-binding domain-containing protein	0.0112	0.0319	0.0702
Giardia lamblia	NADPH oxidoreductase, putative	0.0827	0.2697	1
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Echinococcus granulosus	glutathione S transferase	0.0188	0.0573	1
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.0014	0.0214
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Brugia malayi	Glutathione S-transferase 4	0.0145	0.043	0.095
Giardia lamblia	NADPH oxidoreductase, putative	0.0827	0.2697	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Entamoeba histolytica	hypothetical protein	0.0343	0.1088	1
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0091	0.5426
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	mercuric reductase, putative	0.0022	0.0019	0.0005
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0022	0.0019	0.0369
Schistosoma mansoni	glutathione-S-transferase	0.0188	0.0573	1
Trypanosoma brucei	trypanothione reductase	0.0063	0.0155	1
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Brugia malayi	Helix-loop-helix DNA-binding domain containing protein	0.0112	0.0321	0.071
Schistosoma mansoni	elongation factor 1-gamma	0.0043	0.0091	0.1553
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0002	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0102	0.0222
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0106	0.1816
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0022	0.0019	0.0042
Plasmodium vivax	glutathione reductase, putative	0.0063	0.0155	0.2452
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0022	0.0019	0.0369
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Trypanosoma cruzi	trypanothione reductase, putative	0.0063	0.0155	1
Leishmania major	DNA polymerase eta, putative	0.0047	0.0102	0.6255
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0106	0.1816
Leishmania major	elongation factor-1 gamma	0.0043	0.0091	0.5426
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0052	0.012	0.0265
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Mycobacterium tuberculosis	Probable oxidoreductase	0.0022	0.0019	0.0369
Plasmodium falciparum	elongation factor 1-gamma, putative	0.0043	0.0091	0.1287
Brugia malayi	Flap endonuclease-1	0.0027	0.0037	0.0082
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0106	0.1816
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0063	0.0155	1
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Brugia malayi	Thioredoxin reductase	0.0063	0.0155	0.0343
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0022	0.0019	0.0369
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Onchocerca volvulus		0.0145	0.043	0.5
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0022	0.0019	0.0369
Schistosoma mansoni	eyes absent homolog	0.0092	0.0252	0.4385
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0014	0.0031
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Leishmania major	elongation factor 1-gamma, putative	0.0043	0.0091	0.5426
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.0014	0.0214
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Echinococcus granulosus	glutathione S transferase	0.0043	0.0091	0.1553
Schistosoma mansoni	DNA polymerase eta	0.0047	0.0102	0.1758
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0106	0.1816
Trichomonas vaginalis	flap endonuclease-1, putative	0.0027	0.0037	0.0023
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Echinococcus multilocularis	glutathione S transferase	0.0188	0.0573	1
Loa Loa (eye worm)	hypothetical protein	0.0145	0.043	0.0947
Trypanosoma cruzi	DNA polymerase eta, putative	0.0047	0.0102	0.6255
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0022	0.0019	0.0305
Trichomonas vaginalis	conserved hypothetical protein	0.0343	0.1088	0.1075
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0022	0.0019	0.0369
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Echinococcus granulosus	transcription factor eb	0.0112	0.0321	0.5586
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0022	0.0019	0.5
Trypanosoma cruzi	elongation factor 1-gamma (EF-1-gamma), putative	0.0043	0.0091	0.5426
Echinococcus multilocularis	eukaryotic translation elongation factor 1	0.0043	0.0091	0.1553
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.014
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0027	0.0037	0.1656
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0022	0.0019	0.0369
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Echinococcus multilocularis	glutathione S-transferase	0.0188	0.0573	1
Trichomonas vaginalis	conserved hypothetical protein	0.0827	0.2697	0.2686
Echinococcus granulosus	dna polymerase eta	0.0047	0.0102	0.1758
Echinococcus multilocularis	glutathione S transferase	0.0043	0.0091	0.1553
Leishmania major	DNA polymerase eta, putative	0.0033	0.0056	0.2987
Trichomonas vaginalis	modulator of drug activity B, putative	0.0343	0.1088	0.1075
Treponema pallidum	NADH oxidase	0.0022	0.0019	0.5
Schistosoma mansoni	Glutathione S-transferase 28 kDa (GST 28) (GST class-mu)	0.0188	0.0573	1
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0022	0.0019	0.0369
Echinococcus granulosus	eukaryotic translation elongation factor 1	0.0043	0.0091	0.1553
Loa Loa (eye worm)	flap endonuclease-1	0.0027	0.0037	0.0079
Echinococcus multilocularis	dna polymerase kappa	0.002	0.0014	0.0214
Plasmodium falciparum	glutathione S-transferase	0.0188	0.0573	1
Echinococcus granulosus	prostaglandin H2 D isomerase	0.0188	0.0573	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0106	0.1816
Schistosoma mansoni	GST class-mu	0.0188	0.0573	1
Schistosoma mansoni	flap endonuclease-1	0.0025	0.0029	0.0471

Activities

Activity type	Activity value	Assay description	Source	Reference
ED50 (functional)	= 0.00000003 M	Differentiation inducing activity towards human promyelocytic leukemia cell line HL-60 assayed by nitroblue tetrazolium reduction	ChEMBL.	2704028
ED50 (functional)	= 0.00000003 M	Differentiation inducing activity towards human promyelocytic leukemia cell line HL-60 assayed by nitroblue tetrazolium reduction	ChEMBL.	2704028
Relative activity (functional)	= 0.043	Activity of the compound relative to retinoic acid in differentiating promyelocytic leukemic HL-60 cells	ChEMBL.	2704028

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.

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

PubChem: 13632690

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 290017