TDR Targets

Basic information

Technical information

TDR Targets ID: 1247465
Name: 4-hydroxy-6-methylaminonaphthalene-2-sulfonic acid
MW: 253.274 | Formula: C11H11NO4S
H donors: 3 H acceptors: 4 LogP: 1.55 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CNc1ccc2c(c1)c(O)cc(c2)S(=O)(=O)O
InChi: 1S/C11H11NO4S/c1-12-8-3-2-7-4-9(17(14,15)16)6-11(13)10(7)5-8/h2-6,12-13H,1H3,(H,14,15,16)
InChiKey: SEHCLGZKORRUKN-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

4-hydroxy-6-methylamino-naphthalene-2-sulfonic acid
4-hydroxy-6-methylamino-2-naphthalenesulfonic acid
CBDivE_010197
2-Naphthalenesulfonic acid, 4-hydroxy-6-(methylamino)-
4-Hydroxy-6-(methylamino)naphthalene-2-sulphonic acid
EINECS 228-406-5

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
Leishmania major	DNA polymerase eta, putative	0.0038	0.0698	0.4675
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0108	0.2935	0.2768
Trichomonas vaginalis	AGC family protein kinase	0.0112	0.3056	0.2892
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0773	0.0555
Trichomonas vaginalis	rotamase, putative	0.0039	0.0742	0.0524
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0039	0.0742	0.1812
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.1039	0.0828
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0049	0.1039	0.0828
Brugia malayi	Protein kinase domain containing protein	0.0112	0.3056	0.2892
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.1924	0.1734
Trypanosoma brucei	PAB1-binding protein , putative	0.0055	0.1231	1
Brugia malayi	RNA binding protein	0.0076	0.1924	0.1734
Schistosoma mansoni	hypothetical protein	0.0025	0.027	0.004
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.004	0.0773	0.0555
Trypanosoma brucei	DNA polymerase eta, putative	0.0054	0.121	0.9829
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0034	0.0579	0.0603
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Brugia malayi	hypothetical protein	0.0035	0.0613	0.0392
Mycobacterium ulcerans	glutaminase	0.033	1	1
Brugia malayi	phosphoinositide-dependent protein kinase I	0.0112	0.3056	0.2892
Trichomonas vaginalis	AGC family protein kinase	0.0112	0.3056	0.2892
Schistosoma mansoni	hypothetical protein	0.0205	0.6004	0.591
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Plasmodium falciparum	ataxin-2 like protein, putative	0.0055	0.1231	0.5
Schistosoma mansoni	hypothetical protein	0.0034	0.0579	0.0357
Brugia malayi	latrophilin 2 splice variant baaae	0.0074	0.1844	0.1652
Giardia lamblia	DINP protein human, muc B family	0.0023	0.023	0.5
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0025	0.027	0.0068
Loa Loa (eye worm)	glutaminase	0.033	1	1
Brugia malayi	hypothetical protein	0.0055	0.1231	0.1024
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.1924	0.1734
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.1039	0.1401
Loa Loa (eye worm)	hypothetical protein	0.0054	0.121	0.1003
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0039	0.0742	0.6031
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0112	0.3056	0.2892
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0034	0.0579	0.0357
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.1924	0.1734
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.1924	0.1734
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.1039	0.1401
Schistosoma mansoni	hypothetical protein	0.0034	0.0579	0.0357
Echinococcus multilocularis	geminin	0.0205	0.6004	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0108	0.2935	0.2768
Trypanosoma brucei	unspecified product	0.0023	0.023	0.1871
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0112	0.3056	0.2892
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0034	0.0579	0.0603
Loa Loa (eye worm)	hypothetical protein	0.0074	0.1844	0.1652
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.023	0.1871
Brugia malayi	TAR-binding protein	0.0076	0.1924	0.1734
Echinococcus multilocularis	3 phosphoinositide dependent protein kinase 1	0.0112	0.3056	0.4893
Schistosoma mansoni	hypothetical protein	0.0034	0.0579	0.0357
Echinococcus multilocularis	histone lysine N methyltransferase NSD3	0.004	0.0748	0.0897
Trypanosoma cruzi	DNA polymerase eta, putative	0.0054	0.121	0.979
Echinococcus multilocularis	dna polymerase eta	0.0054	0.121	0.1697
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0023	0.023	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.1039	0.0828
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.004	0.0773	0.0555
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.1039	0.1401
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0039	0.0742	0.5118
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.1924	0.1734
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.1924	0.1734
Toxoplasma gondii	LsmAD domain-containing protein	0.0055	0.1231	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0034	0.0579	0.0603
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.023	0.1871
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0034	0.0579	0.0603
Schistosoma mansoni	SET domain protein	0.004	0.0748	0.053
Echinococcus granulosus	tar DNA binding protein	0.0076	0.1924	0.2934
Echinococcus granulosus	3-phosphoinositide-dependent protein kinase 1	0.0112	0.3056	0.4893
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0108	0.2935	0.2768
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0039	0.0742	0.5118
Schistosoma mansoni	hypothetical protein	0.0074	0.1844	0.1652
Schistosoma mansoni	DNA polymerase eta	0.0054	0.121	0.1003
Trypanosoma cruzi	PAB1-binding protein , putative	0.0055	0.1231	1
Brugia malayi	Latrophilin receptor protein 2	0.0034	0.0579	0.0357
Echinococcus granulosus	histone lysine N methyltransferase NSD3	0.004	0.0748	0.0897
Loa Loa (eye worm)	hypothetical protein	0.0055	0.1231	0.1024
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.1924	0.2934
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.1924	0.1734
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Echinococcus granulosus	expressed protein	0.004	0.0773	0.0939
Leishmania major	hypothetical protein, conserved	0.0055	0.1231	1
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0039	0.0742	0.5118
Loa Loa (eye worm)	glutaminase 2	0.033	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0112	0.3056	0.2892
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.1039	0.1401
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0023	0.023	0.5
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0034	0.0579	0.0357
Schistosoma mansoni	rotamase	0.004	0.0773	0.0555
Brugia malayi	ImpB/MucB/SamB family protein	0.0054	0.121	0.1003
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Trichomonas vaginalis	glutaminase, putative	0.033	1	1
Loa Loa (eye worm)	hypothetical protein	0.0108	0.2935	0.2768
Schistosoma mansoni	hypothetical protein	0.0205	0.6004	0.591
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.1924	0.1734
Leishmania major	DNA polymerase eta, putative	0.0054	0.121	0.979
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0579	0.0357
Toxoplasma gondii	peptidylprolyl isomerase	0.0039	0.0742	0.0831
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0025	0.027	0.0068
Trypanosoma cruzi	DNA polymerase eta, putative	0.0038	0.0698	0.4675
Schistosoma mansoni	serine/threonine protein kinase	0.0112	0.3056	0.2892
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.023	0.1871
Trichomonas vaginalis	rotamase, putative	0.004	0.0773	0.0555
Trypanosoma cruzi	PAB1-binding protein , putative	0.0055	0.1231	1
Echinococcus granulosus	geminin	0.0205	0.6004	1
Loa Loa (eye worm)	RNA binding protein	0.0076	0.1924	0.1734
Schistosoma mansoni	glutaminase	0.033	1	1
Schistosoma mansoni	hypothetical protein	0.0034	0.0579	0.0357
Plasmodium vivax	ataxin-2 like protein, putative	0.0055	0.1231	0.5
Echinococcus granulosus	GPCR family 2	0.0034	0.0579	0.0603
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Echinococcus multilocularis	expressed protein	0.004	0.0773	0.0939
Echinococcus multilocularis	GPCR, family 2	0.0034	0.0579	0.0603
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.1039	0.0828
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0049	0.1039	0.0828
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.023	0.1871
Entamoeba histolytica	protein kinase, putative	0.0112	0.3056	1
Echinococcus granulosus	dna polymerase eta	0.0054	0.121	0.1697
Plasmodium falciparum	ataxin-2 like protein, putative	0.0055	0.1231	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	= 55.7 %	Inhibition of His6x-tagged PRMT1-mediated arginine methylation expressed in Escherichia coli BL21 (DE3) assessed as residual activity at 2 mM using H4(1-20) and [14C]-AdoMet by scintillation counting	ChEMBL.	20666457

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: CHEMBL1269252

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 1247465