TDR Targets

Basic information

Technical information

TDR Targets ID: 214265
Name: 2-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyri din-3-yl)methyl]-2,6-dipropylphenoxy]-2-pheny lacetic acid
MW: 499.644 | Formula: C31H37N3O3
H donors: 1 H acceptors: 4 LogP: 7.83 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: CCCc1cc(cc(c1OC(c1ccccc1)C(=O)O)CCC)Cn1c(CC)nc2c1nc(C)cc2C
InChi: 1S/C31H37N3O3/c1-6-12-24-17-22(19-34-26(8-3)33-27-20(4)16-21(5)32-30(27)34)18-25(13-7-2)28(24)37-29(31(35)36)23-14-10-9-11-15-23/h9-11,14-18,29H,6-8,12-13,19H2,1-5H3,(H,35,36)
InChiKey: OOYQGDVIRBFSHS-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

2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2,6-dipropyl-phenoxy]-2-phenyl-acetic acid
2-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]-2,6-dipropylphenoxy]-2-phenylacetic acid
2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2,6-dipropyl-phenoxy]-2-phenyl-ethanoic acid
alpha-((1-((2-ethyl-5,7-dimethylimidazo(4,5-b)pyridin-3-yl)methyl)-3,5-dipropylphenyl-4-yl)oxy)phenylacetic acid
2-[4-[(2-ethyl-5,7-dimethylimidazo[5,4-b]pyridin-3-yl)methyl]-2,6-dipropylphenoxy]-2-phenylacetic acid
2-[4-[(2-ethyl-5,7-dimethyl-imidazo[5,4-b]pyridin-3-yl)methyl]-2,6-dipropyl-phenoxy]-2-phenyl-acetic acid
2-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[5,4-b]pyridinyl)methyl]-2,6-dipropylphenoxy]-2-phenylacetic acid
2-[4-[(2-ethyl-5,7-dimethyl-imidazo[5,4-b]pyridin-3-yl)methyl]-2,6-dipropyl-phenoxy]-2-phenyl-ethanoic acid
153275-22-0
Diprop-drop-phac acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Angiotensin II type 2 (AT-2) receptor	Starlite/ChEMBL	References
Oryctolagus cuniculus	Angiotensin II type 1a (AT-1a) receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Loa Loa (eye worm)	neuropeptide F receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	356 aa	23.3 %
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	398 aa	18.3 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II type 1a (AT-1a) receptor	359 aa	335 aa	23.0 %
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	Angiotensin II type 1a (AT-1a) receptor	359 aa	306 aa	21.9 %
Echinococcus granulosus	allatostatin A receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	340 aa	24.1 %
Onchocerca volvulus		Angiotensin II type 1a (AT-1a) receptor	359 aa	296 aa	23.0 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Angiotensin II type 2 (AT-2) receptor	363 aa	310 aa	23.5 %
Schistosoma mansoni	opsin-like receptor	Angiotensin II type 1a (AT-1a) receptor	359 aa	299 aa	25.1 %
Brugia malayi	putative neuropeptide receptor NPR1	Angiotensin II type 1a (AT-1a) receptor	359 aa	295 aa	27.1 %
Onchocerca volvulus		Angiotensin II type 1a (AT-1a) receptor	359 aa	399 aa	25.3 %
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	Angiotensin II type 1a (AT-1a) receptor	359 aa	346 aa	18.2 %
Echinococcus granulosus	thyrotropin releasing hormone receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	22.1 %
Onchocerca volvulus	E3 ubiquitin-protein ligase rpm-1 homolog	Angiotensin II type 1a (AT-1a) receptor	359 aa	328 aa	20.7 %
Echinococcus multilocularis	thyrotropin releasing hormone receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	21.8 %
Echinococcus multilocularis	neuropeptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	21.4 %
Echinococcus granulosus	growth hormone secretagogue receptor type 1	Angiotensin II type 1a (AT-1a) receptor	359 aa	342 aa	22.2 %
Brugia malayi	GnHR receptor homolog	Angiotensin II type 1a (AT-1a) receptor	359 aa	364 aa	20.3 %
Onchocerca volvulus		Angiotensin II type 1a (AT-1a) receptor	359 aa	341 aa	23.2 %
Onchocerca volvulus		Angiotensin II type 1a (AT-1a) receptor	359 aa	313 aa	25.6 %
Schistosoma japonicum	ko:K04134 cholinergic receptor, invertebrate, putative	Angiotensin II type 1a (AT-1a) receptor	359 aa	325 aa	20.9 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	311 aa	23.8 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II type 1a (AT-1a) receptor	359 aa	308 aa	27.3 %
Echinococcus multilocularis	G-protein coupled receptor, putative	Angiotensin II type 1a (AT-1a) receptor	359 aa	307 aa	22.5 %
Echinococcus multilocularis	allatostatin A receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	342 aa	24.6 %
Schistosoma mansoni	peptide (allatostatin)-like receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	364 aa	20.9 %
Schistosoma japonicum	Rhodopsin, putative	Angiotensin II type 2 (AT-2) receptor	363 aa	341 aa	22.0 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	306 aa	22.5 %
Echinococcus granulosus	neuropeptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	306 aa	22.2 %
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	398 aa	18.1 %
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	Angiotensin II type 1a (AT-1a) receptor	359 aa	364 aa	23.1 %
Echinococcus granulosus	tm gpcr rhodopsin	Angiotensin II type 1a (AT-1a) receptor	359 aa	306 aa	21.9 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	305 aa	21.6 %
Schistosoma mansoni	adenoreceptor	Angiotensin II type 2 (AT-2) receptor	363 aa	328 aa	22.0 %
Brugia malayi	ORL1-like opioid receptor	Angiotensin II type 1a (AT-1a) receptor	359 aa	333 aa	21.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	thioredoxin glutathione reductase	0.0202	1	1
Echinococcus granulosus	intermediate filament protein	0.0026	0.0533	0.0533
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.007	0.2897	0.2897
Schistosoma mansoni	glutamate synthase	0.0019	0.0131	0.0131
Loa Loa (eye worm)	glutathione reductase	0.0202	1	1
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0039	0.1254	0.1254
Mycobacterium tuberculosis	Probable NADPH dependent 2,4-dienoyl-CoA reductase FadH (2,4-dienoyl coenzyme A reductase) (4-enoyl-CoA reductase)	0.0019	0.0131	0.0131
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.007	0.2897	0.2897
Leishmania major	hypothetical protein, conserved	0.0019	0.0131	0.0131
Echinococcus granulosus	NADPH:adrenodoxin oxidoreductase	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hexokinase	0.0081	0.3513	0.3513
Trypanosoma brucei	unspecified product	0.0027	0.0595	0.0595
Brugia malayi	intermediate filament protein	0.0026	0.0533	0.0533
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.007	0.2897	0.2897
Mycobacterium tuberculosis	Probable dehydrogenase	0.0019	0.0131	0.0131
Trypanosoma cruzi	hexokinase, putative	0.0081	0.3513	0.3513
Toxoplasma gondii	thioredoxin reductase	0.0202	1	1
Echinococcus multilocularis	lamin dm0	0.0026	0.0533	0.0533
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0038	0.1191	0.1191
Trypanosoma cruzi	hypothetical protein, conserved	0.0019	0.0131	0.0131
Echinococcus multilocularis	dna polymerase eta	0.0065	0.2656	0.2656
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0051	0.1873	0.1873
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0039	0.1254	0.1254
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.007	0.2897	1
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.007	0.2897	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.007	0.2897	0.2897
Leishmania major	hexokinase, putative	0.0081	0.3513	0.3513
Trypanosoma brucei	DNA polymerase IV, putative	0.0039	0.1254	0.1254
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Echinococcus multilocularis	hexokinase	0.0081	0.3513	0.3513
Onchocerca volvulus		0.0081	0.3513	1
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0039	0.1254	0.1254
Mycobacterium tuberculosis	Probable NADH-dependent glutamate synthase (small subunit) GltD (L-glutamate synthase) (L-glutamate synthetase) (NADH-glutamate	0.0019	0.0131	0.0131
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0051	0.1873	0.1873
Schistosoma mansoni	disulfide oxidoreductase	0.0019	0.0131	0.0131
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.007	0.2897	1
Schistosoma mansoni	DNA polymerase eta	0.0065	0.2656	0.2656
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0524	0.0524
Trypanosoma cruzi	trypanothione reductase, putative	0.007	0.2897	0.2897
Onchocerca volvulus		0.0026	0.0533	0.119
Leishmania major	hypothetical protein, conserved	0.0026	0.0518	0.0518
Trypanosoma brucei	trypanothione reductase	0.0202	1	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0039	0.1254	0.1254
Echinococcus granulosus	lamin dm0	0.0026	0.0533	0.0533
Echinococcus multilocularis	musashi	0.0026	0.0533	0.0533
Toxoplasma gondii	LsmAD domain-containing protein	0.0026	0.0518	0.0518
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0518	0.0518
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Echinococcus multilocularis	hexokinase	0.0081	0.3513	0.3513
Trypanosoma brucei	PAB1-binding protein , putative	0.0026	0.0518	0.0518
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0019	0.0131	0.0131
Brugia malayi	hypothetical protein	0.0017	0.0026	0.0026
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0533	0.0533
Leishmania major	hexokinase, putative	0.0081	0.3513	0.3513
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0533	0.0533
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase family protein	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.007	0.2897	0.2897
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.007	0.2897	0.2897
Onchocerca volvulus	Hexokinase homolog	0.0051	0.188	0.5172
Loa Loa (eye worm)	programmed cell death 8	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0518	0.0518
Schistosoma mansoni	glutamate synthase	0.0019	0.0131	0.0131
Mycobacterium tuberculosis	Probable thioredoxin reductase TrxB2 (TRXR) (TR)	0.0019	0.0131	0.0131
Echinococcus granulosus	dna polymerase kappa	0.0039	0.1254	0.1254
Onchocerca volvulus		0.0051	0.188	0.5172
Brugia malayi	ImpB/MucB/SamB family protein	0.0039	0.1254	0.1254
Echinococcus granulosus	hexokinase	0.0081	0.3513	0.3513
Mycobacterium tuberculosis	NADPH:adrenodoxin oxidoreductase FprA (NADPH-ferredoxin reductase)	0.0019	0.0131	0.0131
Brugia malayi	hexokinase	0.0081	0.3513	0.3513
Schistosoma mansoni	glutamate synthase	0.0019	0.0131	0.0131
Plasmodium vivax	thioredoxin reductase, putative	0.0202	1	1
Plasmodium falciparum	ferrodoxin reductase-like protein	0.0019	0.0131	0.0131
Leishmania major	NADH dehydrogenase, putative	0.0019	0.0131	0.0131
Echinococcus multilocularis	dna polymerase kappa	0.0039	0.1254	0.1254
Trypanosoma brucei	hexokinase, putative	0.0081	0.3513	0.3513
Toxoplasma gondii	pyridine nucleotide-disulfide oxidoreductase domain-containing protein	0.0019	0.0131	0.0131
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0051	0.1873	0.1873
Plasmodium vivax	ataxin-2 like protein, putative	0.0026	0.0518	0.0518
Trichomonas vaginalis	DNA polymerase eta, putative	0.0039	0.1254	0.4061
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0039	0.1254	0.4061
Trypanosoma cruzi	pyridine nucleotide-disulphide oxidoreductase, putative	0.0019	0.0131	0.0131
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0019	0.0131	0.0131
Trichomonas vaginalis	glutathione reductase, putative	0.007	0.2897	1
Leishmania major	DNA polymerase eta, putative	0.0038	0.1191	0.1191
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0533	0.0533
Trichomonas vaginalis	mercuric reductase, putative	0.007	0.2897	1
Trypanosoma brucei	hexokinase	0.0081	0.3513	0.3513
Plasmodium falciparum	thioredoxin reductase	0.0202	1	1
Echinococcus multilocularis	lamin	0.0026	0.0533	0.0533
Echinococcus multilocularis	glutamate synthase	0.0019	0.0131	0.0131
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.007	0.2897	0.2897
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Schistosoma mansoni	sulfide quinone reductase	0.0019	0.0131	0.0131
Echinococcus granulosus	lamin	0.0026	0.0533	0.0533
Echinococcus granulosus	geminin	0.0173	0.8453	0.8453
Trypanosoma cruzi	DNA polymerase eta, putative	0.0065	0.2656	0.2656
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Mycobacterium tuberculosis	Possible dehydrogenase/reductase	0.0019	0.0131	0.0131
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.007	0.2897	0.2897
Trypanosoma cruzi	pyridine nucleotide-disulphide oxidoreductase, putative	0.0019	0.0131	0.0131
Trypanosoma brucei	unspecified product	0.0039	0.1254	0.1254
Brugia malayi	Hexokinase family protein	0.0081	0.3513	0.3513
Echinococcus multilocularis	pyridine nucleotide disulfide oxidoreductase	0.0019	0.0131	0.0131
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0533	0.0533
Loa Loa (eye worm)	hexokinase type II	0.0081	0.3513	0.3513
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.007	0.2897	0.2897
Echinococcus multilocularis	apoptosis inducing factor 1 mitochondrial	0.0019	0.0131	0.0131
Schistosoma mansoni	lamin	0.0026	0.0533	0.0533
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.007	0.2897	0.2897
Loa Loa (eye worm)	thioredoxin reductase	0.0202	1	1
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.007	0.2897	0.2897
Echinococcus granulosus	apoptosis inducing factor 1 mitochondrial	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0027	0.0595	0.0595
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0019	0.0131	0.0131
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0202	1	1
Schistosoma mansoni	hypothetical protein	0.0019	0.0131	0.0131
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.007	0.2897	0.2897
Brugia malayi	NADPH:adrenodoxin oxidoreductase, mitochondrial precursor	0.0019	0.0131	0.0131
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Echinococcus granulosus	dna polymerase eta	0.0065	0.2656	0.2656
Trypanosoma cruzi	NADPH:adrenodoxin oxidoreductase, mitochondrial, putative	0.0019	0.0131	0.0131
Onchocerca volvulus		0.0081	0.3513	1
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase family protein	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Trypanosoma brucei	hexokinase	0.0081	0.3513	0.3513
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0518	0.0518
Trypanosoma cruzi	NADH dehydrogenase, putative	0.0019	0.0131	0.0131
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0533	0.0533
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0518	0.0518
Mycobacterium ulcerans	DNA polymerase IV	0.0039	0.1254	0.4061
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.007	0.2897	0.2897
Loa Loa (eye worm)	hypothetical protein	0.0035	0.1006	0.1006
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.007	0.2897	0.2897
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0051	0.1898	0.1898
Mycobacterium tuberculosis	Probable NADPH:adrenodoxin oxidoreductase FprB (adrenodoxin reductase) (AR) (ferredoxin-NADP(+) reductase)	0.0019	0.0131	0.0131
Leishmania major	hypothetical protein, conserved	0.0019	0.0131	0.0131
Trypanosoma cruzi	2,4-dienoyl-coa reductase-like protein, putative	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Onchocerca volvulus		0.0081	0.3513	1
Trypanosoma brucei	DNA polymerase eta, putative	0.0065	0.2656	0.2656
Echinococcus multilocularis	hexokinase	0.0081	0.3513	0.3513
Trypanosoma brucei	2,4-dienoyl-coa reductase-like protein	0.0019	0.0131	0.0131
Trypanosoma cruzi	DNA polymerase eta, putative	0.0038	0.1191	0.1191
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.007	0.2897	0.2897
Trypanosoma cruzi	NADH dehydrogenase, putative	0.0019	0.0131	0.0131
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0019	0.0131	0.0131
Plasmodium falciparum	glutathione reductase	0.007	0.2897	0.2897
Loa Loa (eye worm)	hexokinase	0.0081	0.3513	0.3513
Trypanosoma brucei	hypothetical protein, conserved	0.0019	0.0131	0.0131
Schistosoma mansoni	sulfide quinone reductase	0.0019	0.0131	0.0131
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0051	0.1898	0.1898
Echinococcus multilocularis	NADPH:adrenodoxin oxidoreductase	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hexokinase	0.0025	0.0487	0.0487
Entamoeba histolytica	hexokinase 1	0.0081	0.3513	1
Loa Loa (eye worm)	pyridine nucleotide-disufhide oxidoreductase	0.0019	0.0131	0.0131
Brugia malayi	hexokinase type II	0.0026	0.0524	0.0524
Trypanosoma cruzi	2,4-dienoyl-coa reductase fadh1, putative	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0131	0.0131
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Leishmania major	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Brugia malayi	Thioredoxin reductase	0.0202	1	1
Schistosoma mansoni	hypothetical protein	0.0173	0.8453	0.8453
Plasmodium falciparum	glutathione reductase	0.0202	1	1
Plasmodium falciparum	type II NADH:ubiquinone oxidoreductase	0.0019	0.0131	0.0131
Plasmodium falciparum	hexokinase	0.0081	0.3513	0.3513
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0524	0.0524
Trypanosoma brucei	NADH dehydrogenase	0.0019	0.0131	0.0131
Trypanosoma brucei	pyridine nucleotide-disulphide oxidoreductase, putative	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hexokinase	0.0051	0.188	0.188
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.007	0.2897	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0027	0.0595	0.0595
Echinococcus granulosus	sulfide:quinone oxidoreductase	0.0019	0.0131	0.0131
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.007	0.2897	0.2897
Schistosoma mansoni	hexokinase	0.0081	0.3513	0.3513
Echinococcus multilocularis	geminin	0.0173	0.8453	0.8453
Brugia malayi	hypothetical protein	0.0026	0.0518	0.0518
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.007	0.2897	1
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.007	0.2897	1
Leishmania major	DNA polymerase eta, putative	0.0065	0.2656	0.2656
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Brugia malayi	glutamate synthase	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase IV, putative	0.0039	0.1254	0.1254
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0019	0.0131	0.0131
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.007	0.2897	0.2897
Echinococcus granulosus	pyridine nucleotide disulfide oxidoreductase	0.0019	0.0131	0.0131
Leishmania major	hypothetical protein, conserved	0.0019	0.0131	0.0131
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0039	0.1254	0.3322
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Plasmodium vivax	NAD(P)H-dependent glutamate synthase, putative	0.0019	0.0131	0.0131
Trypanosoma brucei	DNA polymerase kappa, putative	0.0027	0.0595	0.0595
Echinococcus granulosus	hexokinase type 2	0.0081	0.3513	0.3513
Schistosoma mansoni	lamin	0.0026	0.0533	0.0533
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0039	0.1254	0.1254
Toxoplasma gondii	pyridine nucleotide-disulfide oxidoreductase domain-containing protein	0.0019	0.0131	0.0131
Plasmodium vivax	hexokinase, putative	0.0081	0.3513	0.3513
Toxoplasma gondii	hexokinase	0.0081	0.3513	0.3513
Toxoplasma gondii	non-proton pumping type-II NADH dehydrogenase I	0.0019	0.0131	0.0131
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0039	0.1254	0.1254
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.007	0.2897	0.2897
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0202	1	1
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0019	0.0131	0.0131
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Trypanosoma brucei	pyridine nucleotide-disulphide oxidoreductase, putative	0.0019	0.0131	0.0131
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0019	0.0131	0.0131
Schistosoma mansoni	hypothetical protein	0.0173	0.8453	0.8453
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.007	0.2897	0.2897
Entamoeba histolytica	hexokinase 2	0.0081	0.3513	1
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.007	0.2897	0.2897
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0518	0.0518
Giardia lamblia	DINP protein human, muc B family	0.0039	0.1254	0.4061
Leishmania major	2,4-dienoyl-coa reductase fadh1, putative	0.0019	0.0131	0.0131
Toxoplasma gondii	selenide, water dikinase	0.0019	0.0131	0.0131
Brugia malayi	latrophilin 2 splice variant baaae	0.0035	0.1006	0.1006
Plasmodium vivax	ferrodoxin reductase, putative	0.0019	0.0131	0.0131
Trypanosoma brucei	NADPH:adrenodoxin oxidoreductase, mitochondrial, putative	0.0019	0.0131	0.0131
Toxoplasma gondii	pyridine nucleotide-disulfide oxidoreductase domain-containing protein	0.0019	0.0131	0.0131
Trypanosoma cruzi	hexokinase, putative	0.0081	0.3513	0.3513
Echinococcus granulosus	hexokinase	0.0081	0.3513	0.3513
Giardia lamblia	NADH oxidase lateral transfer candidate	0.007	0.2897	1
Echinococcus granulosus	hexokinase	0.0081	0.3513	0.3513
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0039	0.1254	0.1254
Brugia malayi	Hexokinase family protein	0.0051	0.188	0.188
Leishmania major	2,4-dienoyl-coa reductase-like protein	0.0019	0.0131	0.0131
Plasmodium vivax	glutathione reductase, putative	0.0202	1	1
Mycobacterium ulcerans	DNA polymerase IV	0.0039	0.1254	0.4061
Trypanosoma cruzi	trypanothione reductase, putative	0.0202	1	1
Treponema pallidum	hexokinase (hxk)	0.0081	0.3513	1
Loa Loa (eye worm)	hypothetical protein	0.0065	0.2656	0.2656
Toxoplasma gondii	NADPH-glutathione reductase	0.007	0.2897	0.2897
Echinococcus multilocularis	hexokinase type 2	0.0081	0.3513	0.3513
Echinococcus granulosus	glutamate synthase	0.0019	0.0131	0.0131
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.007	0.2897	0.2897
Toxoplasma gondii	NADH dehydrogenase (NDH2-II)	0.0019	0.0131	0.0131
Plasmodium vivax	type II NADH:ubiquinone oxidoreductase, putative	0.0019	0.0131	0.0131
Onchocerca volvulus		0.0026	0.0533	0.119
Trypanosoma brucei	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Brugia malayi	Hexokinase family protein	0.0025	0.0487	0.0487
Brugia malayi	ImpB/MucB/SamB family protein	0.0065	0.2656	0.2656
Leishmania major	trypanothione reductase	0.0202	1	1
Trypanosoma brucei	unspecified product	0.0027	0.0595	0.0595
Schistosoma mansoni	hypothetical protein	0.0035	0.1006	0.1006
Plasmodium falciparum	NAD(P)H-dependent glutamate synthase, putative	0.0019	0.0131	0.0131
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Trypanosoma cruzi	hypothetical protein, conserved	0.0019	0.0131	0.0131
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.007	0.2897	0.2897
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0039	0.1254	0.1254
Mycobacterium tuberculosis	Probable reductase	0.0019	0.0131	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0051	0.1873	0.1873
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0039	0.1254	0.1254
Loa Loa (eye worm)	hypothetical protein	0.0056	0.212	0.212
Echinococcus multilocularis	sulfide:quinone oxidoreductase	0.0019	0.0131	0.0131
Plasmodium falciparum	thioredoxin reductase	0.007	0.2897	0.2897
Treponema pallidum	NADH oxidase	0.007	0.2897	0.818
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0507	0.0507
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0039	0.1254	0.1254
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.007	0.2897	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.9 nM	Displacement of [1251][Sar1,IIe8]AII from rabbit aorta Angiotensin II receptor, type 1	ChEMBL.	8246245
IC50 (binding)	= 0.9 nM	Displacement of [1251][Sar1,IIe8]AII from rabbit aorta Angiotensin II receptor, type 1	ChEMBL.	8246245
IC50 (binding)	= 2600 nM	Displacement of [1251][Sar1,IIe8]AII from rat midbrain angiotensin II (AT2) receptor	ChEMBL.	8246245
IC50 (binding)	= 2600 nM	Displacement of [1251][Sar1,IIe8]AII from rat midbrain angiotensin II (AT2) receptor	ChEMBL.	8246245

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

Search by CAS
ChEMBL: CHEMBL122212
PubChem: 192626

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 214265