TDR Targets

Basic information

Technical information

TDR Targets ID: 1168051
Name: 2-[(2-amino-2-iminoethyl)amino]acetic acid
MW: 131.133 | Formula: C4H9N3O2
H donors: 3 H acceptors: 2 LogP: -3.86 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: NC(=N)CNCC(=O)O
InChi: 1S/C4H9N3O2/c5-3(6)1-7-2-4(8)9/h7H,1-2H2,(H3,5,6)(H,8,9)
InChiKey: PQQAMGDLMDLQTK-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-[(2-amino-2-imino-ethyl)amino]acetic acid
2-[(2-amino-2-imino-ethyl)amino]ethanoic acid

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
Mycobacterium ulcerans	lipoprotein LpqF	0.0067	0.0654	0.2882
Brugia malayi	beta-lactamase family protein	0.0037	0.035	0.1013
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0045	0.0425	0.1486
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0239	0.2446	1
Trypanosoma brucei	importin beta-1 subunit, putative	0.0064	0.063	0.6371
Brugia malayi	RNA, U transporter 1	0.0183	0.1862	0.5384
Plasmodium falciparum	histone acetyltransferase GCN5	0.0041	0.0386	0.5507
Loa Loa (eye worm)	beta-lactamase	0.0037	0.035	0.0494
Schistosoma mansoni	hypothetical protein	0.0016	0.0133	0.0064
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0332	0.0468
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Giardia lamblia	Histone acetyltransferase GCN5	0.0041	0.0386	0.2116
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0099	0.0989	0.1393
Plasmodium falciparum	T-complex protein 1 subunit beta	0.0025	0.0225	0.2524
Schistosoma mansoni	hypothetical protein	0.0377	0.3889	0.5424
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0133	0.0187
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0047	0.0453	0.2994
Schistosoma mansoni	serine/threonine protein kinase	0.0099	0.0989	0.1285
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.035	0.1221
Giardia lamblia	Kinase, PLK	0.0099	0.0989	1
Echinococcus granulosus	chaperonin containing TCP1 subunit 2 beta	0.0025	0.0225	0.0316
Echinococcus multilocularis	snurportin 1	0.0685	0.7097	0.7097
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0052	0.0503	0.1764
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.035	0.1013
Brugia malayi	tumor suppressor.	0.0336	0.3458	1
Echinococcus multilocularis	transportin 1	0.0012	0.0088	0.0088
Brugia malayi	beta-lactamase family protein	0.0037	0.035	0.1013
Loa Loa (eye worm)	kap beta 3 protein	0.0012	0.0088	0.0124
Brugia malayi	beta-lactamase	0.0037	0.035	0.1013
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.035	0.3543
Trypanosoma cruzi	polo-like protein kinase, putative	0.0099	0.0989	1
Echinococcus granulosus	geminin	0.0377	0.3889	0.548
Schistosoma mansoni	hypothetical protein	0.0685	0.7097	1
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0151	0.1537	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0045	0.0425	0.6219
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.035	0.1645
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Trypanosoma brucei	beta lactamase	0.0067	0.0654	0.6616
Echinococcus granulosus	protein quaking	0.0028	0.0257	0.0362
Onchocerca volvulus		0.0037	0.035	0.1569
Onchocerca volvulus		0.0037	0.035	0.1569
Brugia malayi	T-complex protein 1, beta subunit	0.0025	0.0225	0.0649
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0133	0.0384
Schistosoma mansoni	ran	0.0047	0.0453	0.0521
Brugia malayi	hypothetical protein	0.0028	0.0257	0.0744
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Brugia malayi	T-complex protein 1, beta subunit	0.0025	0.0225	0.0649
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0047	0.0453	0.0639
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0099	0.0989	1
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0275	0.2828	0.8177
Loa Loa (eye worm)	tumor suppressor	0.0336	0.3458	0.4873
Trypanosoma cruzi	polo-like protein kinase, putative	0.0099	0.0989	1
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0047	0.0453	0.6744
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0052	0.0503	0.1456
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0133	0.0187
Trichomonas vaginalis	hypothetical protein	0.0012	0.0088	0.0291
Loa Loa (eye worm)	hypothetical protein	0.0064	0.063	0.0887
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.035	0.1221
Echinococcus multilocularis	translational activator gcn1	0.0012	0.0088	0.0088
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Schistosoma mansoni	hypothetical protein	0.0028	0.0257	0.0242
Trypanosoma brucei	Importin-beta N-terminal domain/HEAT-like repeat, putative	0.0012	0.0088	0.0888
Entamoeba histolytica	acetyltransferase, GNAT family	0.0041	0.0386	0.3313
Echinococcus granulosus	hypothetical protein	0.0028	0.0257	0.0362
Trichomonas vaginalis	glucosylceramidase, putative	0.019	0.1943	0.6866
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Leishmania major	hypothetical protein, conserved	0.0037	0.035	0.2914
Leishmania major	GTP-binding protein, putative	0.0047	0.0453	0.4058
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0025	0.0225	0.0195
Trichomonas vaginalis	chaperonin, putative	0.0025	0.0225	0.0776
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0503	0.0709
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0133	0.0187
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.035	0.1221
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0133	0.0133
Toxoplasma gondii	t-complex protein beta subunit	0.0025	0.0225	0.2524
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0052	0.0503	0.1456
Schistosoma mansoni	hypothetical protein	0.0036	0.0332	0.0348
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0099	0.0989	0.1393
Plasmodium vivax	importin-beta 2, putative	0.0064	0.063	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0052	0.0503	0.1764
Echinococcus multilocularis	importin subunit beta 1	0.0064	0.063	0.063
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0047	0.0453	0.0639
Trypanosoma brucei	T-complex protein 1, beta subunit, putative	0.0025	0.0225	0.2272
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0133	0.0384
Trichomonas vaginalis	glucosylceramidase, putative	0.019	0.1943	0.6866
Toxoplasma gondii	HEAT repeat-containing protein	0.0064	0.063	1
Schistosoma mansoni	hypothetical protein	0.0028	0.0257	0.0242
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.035	0.1221
Brugia malayi	kap beta 3 protein	0.0012	0.0088	0.0254
Echinococcus granulosus	importin 5	0.0012	0.0088	0.0124
Mycobacterium leprae	PROBABLE CONSERVED LIPOPROTEIN LPQF	0.0067	0.0654	1
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Echinococcus multilocularis	importin 5	0.0012	0.0088	0.0088
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0025	0.0225	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Trypanosoma brucei	ULK family serine/threonine-protein kinase, putative	0.0012	0.0091	0.0922
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0045	0.0425	0.6219
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0099	0.0989	1
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0275	0.2828	0.3984
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.035	0.1221
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.035	0.0374
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0045	0.0425	0.6219
Toxoplasma gondii	ABC1 family protein	0.0037	0.035	0.4843
Onchocerca volvulus		0.0037	0.035	0.1569
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0045	0.0425	0.0599
Entamoeba histolytica	T-complex protein 1 beta subunit, putative	0.0025	0.0225	0.1519
Echinococcus granulosus	transportin 1	0.0012	0.0088	0.0124
Plasmodium vivax	T-complex protein 1 subunit beta, putative	0.0025	0.0225	0.2524
Echinococcus granulosus	GPCR family 2	0.0016	0.0133	0.0187
Schistosoma mansoni	kinase	0.005	0.0483	0.0564
Plasmodium falciparum	importin beta, putative	0.0064	0.063	1
Schistosoma mansoni	importin beta-1	0.0064	0.063	0.0773
Trichomonas vaginalis	importin beta-1, putative	0.0052	0.0503	0.1764
Entamoeba histolytica	hypothetical protein	0.0052	0.0503	0.4614
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0147	0.1493	0.2104
Brugia malayi	serine/threonine-protein kinase plk-2	0.0099	0.0989	0.2858
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.035	0.0494
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Trichomonas vaginalis	CAMK family protein kinase	0.0049	0.047	0.1645
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0685	0.7097	1
Onchocerca volvulus	Glucosylceramidase homolog	0.0181	0.1842	1
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.035	0.4843
Leishmania major	importin beta-1 subunit, putative	0.0052	0.0503	0.4614
Mycobacterium ulcerans	class a beta-lactamase, BlaC	0.0139	0.1404	1
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0052	0.0503	0.3649
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0045	0.0425	0.1486
Trichomonas vaginalis	esterase, putative	0.0037	0.035	0.1221
Echinococcus granulosus	translational activator gcn1	0.0012	0.0088	0.0124
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.035	0.035
Entamoeba histolytica	Ran family GTPase	0.0047	0.0453	0.4058
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0047	0.0453	0.1311
Schistosoma mansoni	hypothetical protein	0.0377	0.3889	0.5424
Trichomonas vaginalis	CAMK family protein kinase	0.0049	0.047	0.1645
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0099	0.0989	0.5176
Schistosoma mansoni	hypothetical protein	0.0016	0.0133	0.0064
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0133	0.0133
Trichomonas vaginalis	ran, putative	0.0047	0.0453	0.1586
Echinococcus multilocularis	protein quaking	0.0028	0.0257	0.0257
Schistosoma mansoni	hypothetical protein	0.0016	0.0133	0.0064
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.035	0.0494
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0025	0.0225	0.0195
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.035	0.1645
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0047	0.0453	0.6744
Brugia malayi	Temporarily assigned gene name protein 44	0.0028	0.0257	0.0744
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0047	0.0453	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0151	0.1537	0.1537
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0099	0.0989	0.0989
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0257	0.0363
Trypanosoma brucei	polo-like protein kinase	0.0099	0.0989	1
Echinococcus granulosus	importin subunit beta 1	0.0064	0.063	0.0887
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0047	0.0453	0.2994
Trypanosoma brucei	importin beta-1 subunit, putative	0.0064	0.063	0.6371
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0047	0.0453	0.4586
Schistosoma mansoni	ran	0.0047	0.0453	0.0521
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.035	0.0374
Echinococcus multilocularis	chaperonin containing TCP1, subunit 2 (beta)	0.0025	0.0225	0.0225
Brugia malayi	Importin beta-1 subunit	0.0064	0.063	0.1821
Leishmania major	T-complex protein 1, beta subunit, putative	0.0025	0.0225	0.1519
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0133	0.0133
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0133	0.0187
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1842	0.6507
Brugia malayi	acetyltransferase, GNAT family protein	0.0151	0.1537	0.4446
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0047	0.0453	0.6744
Loa Loa (eye worm)	T-complex protein 1	0.0025	0.0225	0.0316
Trichomonas vaginalis	chaperonin-60kD, ch60, putative	0.0025	0.0225	0.0776
Loa Loa (eye worm)	importin-beta domain-containing protein	0.0012	0.0088	0.0124
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0047	0.0453	0.2994
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0052	0.0503	0.0709
Echinococcus multilocularis	geminin	0.0377	0.3889	0.3889
Loa Loa (eye worm)	hypothetical protein	0.0037	0.035	0.0494
Schistosoma mansoni	hypothetical protein	0.0016	0.0133	0.0064
Trichomonas vaginalis	CAMK family protein kinase	0.0099	0.0989	0.3483
Mycobacterium tuberculosis	Class a beta-lactamase BlaC	0.0139	0.1404	0.503
Mycobacterium tuberculosis	Probable conserved lipoprotein LpqF	0.0067	0.0654	0.145
Brugia malayi	latrophilin 2 splice variant baaae	0.0036	0.0332	0.096
Trichomonas vaginalis	glucosylceramidase, putative	0.0275	0.2828	1
Loa Loa (eye worm)	acetyltransferase	0.0151	0.1537	0.2166
Echinococcus granulosus	snurportin 1	0.0685	0.7097	1

Activities

No activities found for this compound.

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: CHEMBL1195878

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1168051