TDR Targets

Basic information

Technical information

TDR Targets ID: 1432701
Name: ethyl 2,4-dimethyl-5-[2-[4-methyl-4-(2-methyl propyl)-2,5-dioxoimidazolidin-1-yl]acetyl]-1H -pyrrole-3-carboxylate
MW: 377.435 | Formula: C19H27N3O5
H donors: 2 H acceptors: 4 LogP: 2.57 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)c1c(C)[nH]c(c1C)C(=O)CN1C(=O)NC(C1=O)(C)CC(C)C
InChi: 1S/C19H27N3O5/c1-7-27-16(24)14-11(4)15(20-12(14)5)13(23)9-22-17(25)19(6,8-10(2)3)21-18(22)26/h10,20H,7-9H2,1-6H3,(H,21,26)
InChiKey: LAUOWRVPALCKDC-UHFFFAOYSA-N

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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

ethyl 5-[2-(4-isobutyl-4-methyl-2,5-dioxo-imidazolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
5-[2-(4-isobutyl-4-methyl-2,5-dioxo-1-imidazolidinyl)-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
5-[2-(4-isobutyl-2,5-diketo-4-methyl-imidazolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
ethyl 2,4-dimethyl-5-[2-[4-methyl-4-(2-methylpropyl)-2,5-dioxo-imidazolidin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate
MLS000770756
SMR000343955
T5502449

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470

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
Brugia malayi	Inositol-1	0.0077	0.1684	0.2017
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0299	0.0062
Trypanosoma brucei	protein kinase, putative	0.0059	0.1098	0.3452
Echinococcus multilocularis	chromobox protein 1	0.008	0.1805	0.206
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0675	0.0564
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0233	0.6906	0.8839
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0077	0.1684	0.172
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0233	0.6906	0.8839
Brugia malayi	latrophilin 2 splice variant baaae	0.0072	0.1544	0.1849
Trichomonas vaginalis	conserved hypothetical protein	0.0045	0.0631	0.0517
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.0299	0.0067
Echinococcus granulosus	survival motor neuron protein 1	0.026	0.7804	1
Brugia malayi	beta-lactamase	0.0035	0.0299	0.0358
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0018
Trichomonas vaginalis	chromobox protein, putative	0.008	0.1805	0.1905
Plasmodium vivax	SET domain protein, putative	0.0036	0.0333	0.0149
Loa Loa (eye worm)	glutaminase 2	0.0277	0.8348	1
Echinococcus granulosus	chromobox protein 1	0.008	0.1805	0.206
Onchocerca volvulus		0.0049	0.077	0.0563
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0105	0.2614	0.277
Plasmodium falciparum	glutathione reductase	0.0102	0.254	1
Trichomonas vaginalis	chromobox protein, putative	0.0048	0.0744	0.0651
Loa Loa (eye worm)	hypothetical protein	0.026	0.7804	0.9329
Mycobacterium tuberculosis	Probable dehydrogenase	0.0233	0.6906	0.8839
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0053	0.0901	0.108
Trichomonas vaginalis	esterase, putative	0.0035	0.0299	0.0125
Brugia malayi	glutaminase DH11.1	0.0277	0.8348	1
Mycobacterium tuberculosis	Probable reductase	0.0233	0.6906	0.8839
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0233	0.6906	0.8839
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.1098	0.107
Brugia malayi	beta-lactamase family protein	0.0035	0.0299	0.0358
Schistosoma mansoni	kinase	0.0053	0.0911	0.0679
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.1098	0.107
Echinococcus granulosus	thioredoxin glutathione reductase	0.0102	0.254	0.3033
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0077	0.1684	1
Trypanosoma cruzi	polo-like protein kinase, putative	0.0105	0.2614	1
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Mycobacterium tuberculosis	Probable oxidoreductase	0.026	0.7773	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0299	0.0125
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.1098	0.107
Treponema pallidum	NADH oxidase	0.0035	0.0313	0.5
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0035	0.0313	0.0061
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.026	0.7773	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0299	0.0358
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0299	0.0052
Toxoplasma gondii	thioredoxin reductase	0.0102	0.254	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0675	0.0808
Echinococcus multilocularis	mitogen activated protein kinase	0.0059	0.1098	0.1124
Leishmania major	trypanothione reductase	0.0102	0.254	0.968
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0045	0.0631	0.0397
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0233	0.6906	0.8839
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0036	0.0333	0.0149
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0059	0.1098	0.1049
Loa Loa (eye worm)	thioredoxin reductase	0.0102	0.254	0.2829
Mycobacterium ulcerans	glutaminase	0.0277	0.8348	1
Schistosoma mansoni	hypothetical protein	0.0053	0.0901	0.0669
Schistosoma mansoni	hypothetical protein	0.0043	0.0579	0.0339
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0035	0.0313	0.0061
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.8656	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0035	0.0313	0.0061
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0086
Trichomonas vaginalis	chromobox protein, putative	0.008	0.1805	0.1905
Schistosoma mansoni	inositol monophosphatase	0.0077	0.1684	0.1472
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.0579	0.0437
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0675	0.0564
Brugia malayi	glutathione reductase	0.0102	0.254	0.3043
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0035	0.0313	0.0061
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0059	0.1098	0.3452
Trypanosoma cruzi	trypanothione reductase, putative	0.0035	0.0313	0.0061
Loa Loa (eye worm)	glutathione reductase	0.0102	0.254	0.2829
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0105	0.2614	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.75	0.8953
Schistosoma mansoni	glutaminase	0.0277	0.8348	0.8306
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0105	0.2614	0.3131
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0061
Loa Loa (eye worm)	heterochromatin protein 1	0.008	0.1805	0.1921
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0224	0.6586	0.8412
Brugia malayi	serine/threonine-protein kinase plk-2	0.0105	0.2614	0.3132
Loa Loa (eye worm)	glutaminase	0.0277	0.8348	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0102	0.254	0.968
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0036	0.0333	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0307	0.0072
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.0579	0.0339
Trypanosoma cruzi	polo-like protein kinase, putative	0.0105	0.2614	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0675	0.0437
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.0035	0.0313	0.0063
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0059	0.1098	0.3566
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0299	0.0125
Echinococcus multilocularis	inositol monophosphatase 1	0.0077	0.1684	0.1899
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0035	0.0313	0.0018
Giardia lamblia	Kinase, PLK	0.0105	0.2614	1
Plasmodium falciparum	thioredoxin reductase	0.0102	0.254	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0299	0.0125
Brugia malayi	Heterochromatin protein 1	0.008	0.1805	0.2162
Trichomonas vaginalis	mercuric reductase, putative	0.0035	0.0313	0.0142
Schistosoma mansoni	chromobox protein	0.008	0.1805	0.1596
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0069	0.1416	0.1495
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0675	0.0437
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0299	0.0062
Trichomonas vaginalis	CAMK family protein kinase	0.0052	0.0865	0.0794
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0061
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0106	0.266	0.3186
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0333	0.0086
Trichomonas vaginalis	CMGC family protein kinase	0.0059	0.1098	0.107
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.0035	0.0313	0.0063
Loa Loa (eye worm)	inositol-1	0.0077	0.1684	0.1772
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0035	0.0313	0.0375
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.026	0.7773	1
Plasmodium vivax	glutathione reductase, putative	0.0102	0.254	1
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0059	0.1098	0.3452
Brugia malayi	Pre-SET motif family protein	0.0251	0.75	0.8984
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0035	0.0313	0.0063
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0035	0.0313	0.0019
Trichomonas vaginalis	conserved hypothetical protein	0.0045	0.0631	0.0517
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0059	0.1098	0.3452
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Echinococcus granulosus	mitogen activated protein kinase	0.0059	0.1098	0.1124
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0675	0.0526
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0233	0.6906	0.8839
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0299	0.0125
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0035	0.0313	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0631	0.0472
Trypanosoma brucei	trypanothione reductase	0.0102	0.254	0.968
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0066
Onchocerca volvulus		0.0053	0.0901	0.0721
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0102	0.254	0.3033
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1544	0.1599
Schistosoma mansoni	hypothetical protein	0.0072	0.1544	0.1328
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Trypanosoma brucei	polo-like protein kinase	0.0105	0.2614	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.0579	0.0437
Trichomonas vaginalis	chromobox protein, putative	0.0048	0.0744	0.0651
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0105	0.2614	0.2921
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0333	0.0104
Schistosoma mansoni	chromobox protein	0.008	0.1805	0.1596
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0035	0.0313	0.0018
Brugia malayi	Pre-SET motif family protein	0.0036	0.0333	0.0399
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.026	0.7773	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0299	0.0052
Brugia malayi	beta-lactamase family protein	0.0035	0.0299	0.0358
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0105	0.2614	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0675	0.0437
Echinococcus granulosus	chromobox protein 1	0.008	0.1805	0.206
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0106	0.266	0.3186
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0059	0.1098	0.3452
Trichomonas vaginalis	glutathione reductase, putative	0.0035	0.0313	0.0142
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.0333	0.0111
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0048	0.0744	0.0533
Brugia malayi	Latrophilin receptor protein 2	0.0034	0.0249	0.0298
Brugia malayi	Thioredoxin reductase	0.0102	0.254	0.3043
Echinococcus granulosus	inositol monophosphatase 1	0.0077	0.1684	0.1899
Brugia malayi	MAP kinase sur-1	0.0059	0.1098	0.1316
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0077	0.1684	0.1762
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0675	0.0564
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0102	0.254	0.2998
Schistosoma mansoni	survival motor neuron protein	0.0053	0.0901	0.0669
Giardia lamblia	Kinase, CMGC MAPK	0.0059	0.1098	0.3411
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0059	0.1098	0.1124
Plasmodium vivax	thioredoxin reductase, putative	0.0102	0.254	1
Schistosoma mansoni	inositol monophosphatase	0.0077	0.1684	0.1472
Echinococcus multilocularis	chromobox protein 1	0.008	0.1805	0.206
Brugia malayi	hypothetical protein	0.026	0.7804	0.9349
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0077	0.1684	0.5981
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0035	0.0313	0.5
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0299	0.0125
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0299	0.0062
Schistosoma mansoni	serine/threonine protein kinase	0.0105	0.2614	0.2426
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0049	0.077	0.0535
Schistosoma mansoni	serine/threonine protein kinase	0.0059	0.1098	0.0871
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0059	0.1098	0.3452
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0333	0.0086
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.0299	0.0067
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0034	0.0249	0.0298
Echinococcus multilocularis	survival motor neuron protein 1	0.026	0.7804	1
Onchocerca volvulus		0.0286	0.8656	1
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0077	0.1684	0.5981
Loa Loa (eye worm)	hypothetical protein	0.0106	0.266	0.2977
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0675	0.0564
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0105	0.2614	0.3131
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0069	0.1416	0.1495
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0059	0.1098	0.3452
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0059	0.1098	0.3452
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0077	0.1684	0.1762
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0333	0.0086
Echinococcus granulosus	mitogen activated protein kinase 3	0.0059	0.1098	0.1124
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0077	0.1684	0.6179
Trichomonas vaginalis	glutaminase, putative	0.0277	0.8348	0.9636
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0077	0.1684	0.5981
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0106	0.266	0.2977
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0035	0.0313	0.0086
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0077	0.1684	0.5429
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0035	0.0313	0.0061
Toxoplasma gondii	NADPH-glutathione reductase	0.0035	0.0313	0.0063
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0036	0.0333	0.0111
Onchocerca volvulus		0.0035	0.0307	0.0009
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0035	0.0313	0.0061
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.0289	0.0053
Brugia malayi	hypothetical protein	0.0043	0.0579	0.0694
Trichomonas vaginalis	CAMK family protein kinase	0.0052	0.0865	0.0794
Trichomonas vaginalis	inositol monophosphatase, putative	0.0077	0.1684	0.1762
Trichomonas vaginalis	CAMK family protein kinase	0.0105	0.2614	0.2861
Brugia malayi	chromobox protein homolog 3	0.0045	0.0631	0.0755
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0077	0.1684	0.5981

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.1413 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	18.3564 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference

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

ChEMBL: CHEMBL1575107

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1432701