TDR Targets

Basic information

Technical information

TDR Targets ID: 213673
Name: methyl 4-[[5-[(Z)-[3-[(5-bromothiophen-2-yl)m ethyl]-1-butyl-2,5-dioxoimidazolidin-4-yliden e]methyl]-2-butylimidazol-1-yl]methyl]benzoat e
MW: 613.566 | Formula: C29H33BrN4O4S
H donors: 0 H acceptors: 4 LogP: 6.24 Rotable bonds: 13
Rule of 5 violations (Lipinski): 2
SMILES: CCCCc1ncc(n1Cc1ccc(cc1)C(=O)OC)/C=C/1\N(Cc2ccc(s2)Br)C(=O)N(C1=O)CCCC
InChi: 1S/C29H33BrN4O4S/c1-4-6-8-26-31-17-22(33(26)18-20-9-11-21(12-10-20)28(36)38-3)16-24-27(35)32(15-7-5-2)29(37)34(24)19-23-13-14-25(30)39-23/h9-14,16-17H,4-8,15,18-19H2,1-3H3/b24-16-
InChiKey: QCNQMWJGIPVCEL-JLPGSUDCSA-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-[[5-[(Z)-[3-[(5-bromo-2-thienyl)methyl]-1-butyl-2,5-dioxo-imidazolidin-4-ylidene]methyl]-2-butyl-imidazol-1-yl]methyl]benzoate
4-[[5-[(Z)-[3-[(5-bromo-2-thienyl)methyl]-1-butyl-2,5-dioxo-4-imidazolidinylidene]methyl]-2-butyl-1-imidazolyl]methyl]benzoic acid methyl ester
methyl 4-[[5-[(Z)-[3-[(5-bromothiophen-2-yl)methyl]-1-butyl-2,5-dioxo-imidazolidin-4-ylidene]methyl]-2-butyl-imidazol-1-yl]methyl]benzoate
4-[[5-[(Z)-[3-[(5-bromo-2-thienyl)methyl]-1-butyl-2,5-diketo-imidazolidin-4-ylidene]methyl]-2-butyl-imidazol-1-yl]methyl]benzoic acid methyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	angiotensin II receptor, type 1	Starlite/ChEMBL	No references
Rattus norvegicus	Angiotensin II receptor (AT-1) type-1	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
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	355 aa	23.9 %
Echinococcus granulosus	neuropeptide receptor	Angiotensin II receptor (AT-1) type-1	359 aa	317 aa	24.6 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	305 aa	24.9 %
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	angiotensin II receptor, type 1	359 aa	403 aa	19.1 %
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	Angiotensin II receptor (AT-1) type-1	359 aa	350 aa	23.1 %
Schistosoma japonicum	ko:K04134 cholinergic receptor, invertebrate, putative	Angiotensin II receptor (AT-1) type-1	359 aa	325 aa	20.9 %
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	Angiotensin II receptor (AT-1) type-1	359 aa	300 aa	21.0 %
Loa Loa (eye worm)	neuropeptide F receptor	Angiotensin II receptor (AT-1) type-1	359 aa	344 aa	23.5 %
Brugia malayi	ORL1-like opioid receptor	Angiotensin II receptor (AT-1) type-1	359 aa	314 aa	20.4 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II receptor (AT-1) type-1	359 aa	329 aa	24.0 %
Echinococcus granulosus	growth hormone secretagogue receptor type 1	Angiotensin II receptor (AT-1) type-1	359 aa	343 aa	23.0 %
Brugia malayi	GnHR receptor homolog	Angiotensin II receptor (AT-1) type-1	359 aa	357 aa	20.4 %
Echinococcus granulosus	thyrotropin releasing hormone receptor	Angiotensin II receptor (AT-1) type-1	359 aa	363 aa	23.7 %
Echinococcus multilocularis	neuropeptide receptor	Angiotensin II receptor (AT-1) type-1	359 aa	317 aa	24.9 %
Echinococcus granulosus	tm gpcr rhodopsin	Angiotensin II receptor (AT-1) type-1	359 aa	300 aa	21.0 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	350 aa	24.0 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Angiotensin II receptor (AT-1) type-1	359 aa	307 aa	24.1 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	309 aa	18.8 %
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	Angiotensin II receptor (AT-1) type-1	359 aa	365 aa	20.0 %
Echinococcus multilocularis	thyrotropin releasing hormone receptor	Angiotensin II receptor (AT-1) type-1	359 aa	363 aa	23.4 %
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	Angiotensin II receptor (AT-1) type-1	359 aa	366 aa	19.7 %
Brugia malayi	putative neuropeptide receptor NPR1	Angiotensin II receptor (AT-1) type-1	359 aa	295 aa	27.1 %
Echinococcus granulosus	allatostatin A receptor	Angiotensin II receptor (AT-1) type-1	359 aa	342 aa	27.2 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	386 aa	24.4 %
Echinococcus multilocularis	G-protein coupled receptor, putative	Angiotensin II receptor (AT-1) type-1	359 aa	307 aa	22.1 %
Echinococcus multilocularis	allatostatin A receptor	Angiotensin II receptor (AT-1) type-1	359 aa	342 aa	26.6 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	314 aa	25.2 %
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	Angiotensin II receptor (AT-1) type-1	359 aa	346 aa	18.2 %
Schistosoma mansoni	opsin-like receptor	Angiotensin II receptor (AT-1) type-1	359 aa	299 aa	25.8 %
Schistosoma mansoni	peptide (allatostatin)-like receptor	Angiotensin II receptor (AT-1) type-1	359 aa	323 aa	25.7 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II receptor (AT-1) type-1	359 aa	308 aa	27.6 %
Onchocerca volvulus	E3 ubiquitin-protein ligase rpm-1 homolog	Angiotensin II receptor (AT-1) type-1	359 aa	354 aa	20.6 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	292 aa	24.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	aldehyde dehydrogenase	0.0124	0.0775	0.0775
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0109	0.0203
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.0109	0.13
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.003	0.0059	0.0231
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0074	0.0886
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.0109	0.0429
Brugia malayi	reverse transcriptase	0.003	0.0059	0.0231
Brugia malayi	beta-lactamase family protein	0.0037	0.0109	0.0429
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0109	0.5
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0109	0.0322
Toxoplasma gondii	ribonuclease HI protein	0.0354	0.2541	1
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.0109	0.0051
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Brugia malayi	reverse transcriptase	0.003	0.0059	0.0231
Loa Loa (eye worm)	MH2 domain-containing protein	0.0132	0.0839	1
Mycobacterium tuberculosis	Probable esterase LipL	0.0037	0.0109	0.0322
Onchocerca volvulus		0.003	0.0059	0.0231
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0074	0.0292
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0109	0.0322
Trypanosoma cruzi	ribonuclease H1, putative	0.0354	0.2541	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0058	0.0276	0.25
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Mycobacterium leprae	Probable lipase LipE	0.0037	0.0109	0.5
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0109	0.0203
Brugia malayi	hypothetical protein	0.003	0.0059	0.0231
Brugia malayi	RNase H family protein	0.0354	0.2541	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0101	0.0606	0.2384
Schistosoma mansoni	cellular tumor antigen P53	0.005	0.0214	0.0214
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0124	0.0775	0.3051
Echinococcus multilocularis	ribonuclease H1	0.0354	0.2541	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Schistosoma mansoni	hypothetical protein	0.0032	0.0074	0.0074
Brugia malayi	RNase H family protein	0.0354	0.2541	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0074	0.0886
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0109	0.0203
Schistosoma mansoni	phosphoglucomutase	0.0354	0.2541	0.2541
Loa Loa (eye worm)	hypothetical protein	0.0069	0.036	0.4288
Schistosoma mansoni	hypothetical protein	0.003	0.0059	0.0059
Schistosoma mansoni	hypothetical protein	0.0032	0.0074	0.0074
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Schistosoma mansoni	hypothetical protein	0.0032	0.0074	0.0074
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Echinococcus granulosus	tumor protein p63	0.0344	0.2463	0.9692
Trypanosoma cruzi	cysteine peptidase, putative	0.0065	0.0326	0.1075
Brugia malayi	reverse transcriptase	0.003	0.0059	0.0231
Toxoplasma gondii	aldehyde dehydrogenase	0.0124	0.0775	0.2739
Giardia lamblia	Ribonuclease H	0.0354	0.2541	1
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0074	0.0292
Leishmania major	cathepsin L-like protease	0.0065	0.0326	0.0891
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0074	0.0292
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0058	0.0276	0.0276
Leishmania major	cathepsin L-like protease	0.0065	0.0326	0.0891
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0109	0.0322
Echinococcus multilocularis	RNA directed DNA polymerase	0.003	0.0059	0.0231
Trypanosoma cruzi	cysteine peptidase, putative	0.0065	0.0326	0.1075
Schistosoma mansoni	serine/threonine protein kinase	0.003	0.0059	0.0059
Trypanosoma brucei	ribonuclease H1	0.0354	0.2541	0.2497
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Loa Loa (eye worm)	beta-lactamase	0.0037	0.0109	0.13
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0058	0.0276	0.1085
Mycobacterium tuberculosis	Probable lipase LipE	0.0037	0.0109	0.0322
Trypanosoma brucei	retrotransposon hot spot protein 4 (RHS4), interrupted	0.0384	0.2771	0.2728
Schistosoma mansoni	hypothetical protein	0.0032	0.0074	0.0074
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Echinococcus granulosus	ribonuclease H1	0.0354	0.2541	1
Onchocerca volvulus		0.003	0.0059	0.0231
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0074	0.0292
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Brugia malayi	Zinc knuckle family protein	0.003	0.0059	0.0231
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0037	0.0109	0.0322
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0606	0.722
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0074	0.0292
Trichomonas vaginalis	ribonuclease H1, putative	0.0354	0.2541	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0124	0.0775	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0059	0.0283	0.0902
Trypanosoma cruzi	major cysteine proteinase, putative	0.0051	0.0219	0.0647
Onchocerca volvulus	Ribonuclease H1 homolog	0.0354	0.2541	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0109	0.0109
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Echinococcus granulosus	RNA directed DNA polymerase	0.003	0.0059	0.0231
Loa Loa (eye worm)	transcription factor SMAD2	0.0132	0.0839	1
Trypanosoma cruzi	ribonuclease H1, putative	0.0354	0.2541	1
Schistosoma mansoni	hypothetical protein	0.003	0.0059	0.0059
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0037	0.0109	0.0322
Onchocerca volvulus		0.0037	0.0109	0.0429
Echinococcus granulosus	RNA directed DNA polymerase reverse transcriptase	0.003	0.0059	0.0231
Schistosoma mansoni	protein kinase	0.003	0.0059	0.0059
Echinococcus multilocularis	tumor protein p63	0.0344	0.2463	0.9692
Mycobacterium tuberculosis	Probable hydrolase	0.0037	0.0109	0.0322
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0074	0.0292
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0074	0.0292
Trypanosoma cruzi	cruzipain precursor, putative	0.0065	0.0326	0.1075
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Leishmania major	ribonuclease H1, putative	0.0354	0.2541	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0109	0.0203
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0234	0.1622	1
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.0109	0.0429
Brugia malayi	MH2 domain containing protein	0.0132	0.0839	0.3301
Schistosoma mansoni	hypothetical protein	0.0069	0.036	0.036
Loa Loa (eye worm)	hypothetical protein	0.005	0.0214	0.2551
Onchocerca volvulus		0.0037	0.0109	0.0429
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Treponema pallidum	ribonuclease H (rnhA)	0.0354	0.2541	0.5
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Trichomonas vaginalis	esterase, putative	0.0037	0.0109	0.0203
Brugia malayi	hypothetical protein	0.003	0.0059	0.0231
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0109	0.0203
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0037	0.0109	0.0322
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0058	0.0276	0.1085
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0058	0.0276	0.25
Trypanosoma brucei	RNA helicase, putative	0.1327	1	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0124	0.0775	1
Schistosoma mansoni	scy1(yeast) protein kinase-like	0.003	0.0059	0.0059
Brugia malayi	latrophilin 2 splice variant baaae	0.0069	0.036	0.1416
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Leishmania major	cathepsin L-like protease	0.0065	0.0326	0.0891
Brugia malayi	RNase H family protein	0.0354	0.2541	1
Trypanosoma brucei	ingi protein (ORF1)	0.0384	0.2771	0.2728
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Echinococcus granulosus	RNA directed DNA polymerase reverse transcriptase	0.003	0.0059	0.0231
Trypanosoma brucei	hypothetical protein, conserved	0.0384	0.2771	0.2728
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0109	0.0203
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0065	0.0326	0.0269
Brugia malayi	Zinc knuckle family protein	0.003	0.0059	0.0231
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0109	0.0203
Brugia malayi	hypothetical protein	0.003	0.0059	0.0231
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0058	0.0276	0.1387
Echinococcus granulosus	GPCR family 2	0.0032	0.0074	0.0292
Schistosoma mansoni	phosphoglucomutase	0.0354	0.2541	0.2541
Brugia malayi	beta-lactamase	0.0037	0.0109	0.0429
Echinococcus granulosus	RNA directed DNA polymerase reverse transcriptase	0.003	0.0059	0.0231
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0109	0.0109
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Mycobacterium leprae	conserved hypothetical protein	0.0037	0.0109	0.5
Brugia malayi	hypothetical protein	0.003	0.0059	0.0231
Brugia malayi	beta-lactamase family protein	0.0037	0.0109	0.0429
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0058	0.0276	0.1085
Trypanosoma brucei	unspecified product	0.0384	0.2771	0.2728
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0109	0.13
Mycobacterium tuberculosis	Probable lipase LipD	0.0037	0.0109	0.0322
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0058	0.0276	0.0685
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0101	0.0606	0.722
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0124	0.0775	0.3051
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0054	0.0246	0.2927
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Echinococcus granulosus	RNA directed DNA polymerase reverse transcriptase	0.003	0.0059	0.0231
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.0109	0.0429
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Wolbachia endosymbiont of Brugia malayi	ribonuclease HI	0.0354	0.2541	0.5
Schistosoma mansoni	phosphoglucomutase	0.0354	0.2541	0.2541
Onchocerca volvulus		0.005	0.0214	0.0842
Schistosoma mansoni	aldehyde dehydrogenase	0.0124	0.0775	0.0775
Trypanosoma cruzi	cysteine peptidase, putative	0.0065	0.0326	0.1075
Brugia malayi	Pao retrotransposon peptidase family protein	0.003	0.0059	0.0231
Onchocerca volvulus	Telomerase reverse transcriptase homolog	0.003	0.0059	0.0231
Trypanosoma brucei	ingi protein (ORF1)	0.0384	0.2771	0.2728
Echinococcus multilocularis	RNA directed DNA polymerase (reverse transcriptase)	0.003	0.0059	0.0231
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0124	0.0775	0.4583
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0101	0.0606	0.2384
Onchocerca volvulus		0.0037	0.0109	0.0429
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0124	0.0775	0.2739
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0124	0.0775	1
Echinococcus granulosus	KRAB A domain containing protein	0.003	0.0059	0.0231

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 17.8 nM	Binding affinity expressed as IC50 to the Angiotensin II receptor, type 1, from rat liver membrane	ChEMBL.	7562906
IC50 (binding)	= 17.8 nM	Binding affinity expressed as IC50 to the Angiotensin II receptor, type 1, from rat liver membrane	ChEMBL.	7562906
IC50 (binding)	= 17.8 nM	Antagonist activity at angiotensin 2 type-1 receptor (unknown origin)	ChEMBL.	No reference
log(1/C) (binding)	= -1.25	Antagonist activity at angiotensin 2 type-1 receptor (unknown origin)	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: CHEMBL331121
PubChem: 11758470

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 213673