TDR Targets

Basic information

Technical information

TDR Targets ID: 1425198
Name: 2-amino-2-(4-sulfophenyl)propanoic acid
MW: 245.252 | Formula: C9H11NO5S
H donors: 3 H acceptors: 5 LogP: -2.77 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)C(c1ccc(cc1)S(=O)(=O)O)(N)C
InChi: 1S/C9H11NO5S/c1-9(10,8(11)12)6-2-4-7(5-3-6)16(13,14)15/h2-5H,10H2,1H3,(H,11,12)(H,13,14,15)
InChiKey: MVDSFPIEJILRME-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-amino-2-(4-sulfophenyl)propionic acid
MSPG
NCGC00024827-02

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	aldehyde dehydrogenase 1 family, member A1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase X, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania mexicana	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania infantum	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania braziliensis	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Toxoplasma gondii	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Neospora caninum	hypothetical protein	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Retinal dehydrogenase 1, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania donovani	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Mycobacterium tuberculosis	Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1	aldehyde dehydrogenase 1 family, member A1	501 aa	456 aa	33.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0683	1
Echinococcus multilocularis	tar DNA binding protein	0.0062	0.2943	0.2749
Brugia malayi	6-phosphofructokinase	0.0107	0.5959	0.6138
Trypanosoma brucei	DNA polymerase kappa, putative	0.0026	0.0518	0.044
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0074	0.3737	0.6096
Schistosoma mansoni	hypothetical protein	0.0166	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2943	0.2749
Brugia malayi	Doublecortin family protein	0.0024	0.0342	0.008
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0038	0.1323	0.132
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.0342	0.0076
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0528	0.0772
Loa Loa (eye worm)	phosphofructokinase	0.0107	0.5959	0.6217
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0683	1
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0038	0.1323	0.1854
Trichomonas vaginalis	6-phosphofructokinase, putative	0.0029	0.0683	0.073
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0023	0.0268	0.0205
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0528	0.0281
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0074	0.3737	0.6096
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0107	0.5959	1
Entamoeba histolytica	phosphofructokinase, putative	0.0107	0.5959	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0027	0.0528	0.0772
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0091	0.4876	0.4736
Echinococcus multilocularis	Polycystic kidney disease protein	0.0024	0.0342	0.0076
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0023	0.0268	0.033
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0038	0.1323	0.1084
Trichomonas vaginalis	phosphofructokinase, putative	0.0107	0.5959	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0268	0.3186
Schistosoma mansoni	polycystin 1-related	0.0024	0.0342	0.0076
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0038	0.1323	0.1084
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0074	0.3737	0.3565
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0528	0.0458
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2943	0.2749
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.4876	0.4736
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2943	0.2749
Trichomonas vaginalis	phosphofructokinase, putative	0.0107	0.5959	1
Brugia malayi	Pip kinase protein 2	0.016	0.9541	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0038	0.1323	0.1854
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0107	0.5959	1
Schistosoma mansoni	loxhd1	0.0024	0.0342	0.0076
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0038	0.1323	0.1084
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0.0268	0.5
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0074	0.3737	0.387
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0683	1
Schistosoma mansoni	hypothetical protein	0.0166	1	1
Trypanosoma brucei	unspecified product	0.0026	0.0518	0.044
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0038	0.1323	0.222
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Echinococcus multilocularis	geminin	0.0166	1	1
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0074	0.3737	0.6096
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0023	0.0268	0.0449
Trichomonas vaginalis	DNA polymerase eta, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	dna polymerase kappa	0.0038	0.1323	0.1084
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0683	0.1211
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0683	1
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0528	0.0281
Brugia malayi	RNA recognition motif domain containing protein	0.0062	0.2943	0.2885
Schistosoma mansoni	6-phosphofructokinase	0.0107	0.5959	0.5848
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0074	0.3737	0.3565
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.0342	0.0076
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0027	0.0528	0.0772
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0268	0.3186
Echinococcus granulosus	Polycystic kidney disease protein	0.0024	0.0342	0.0076
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0027	0.0528	0.0886
Entamoeba histolytica	phosphofructokinase, putative	0.0107	0.5959	1
Giardia lamblia	DINP protein human, muc B family	0.0038	0.1323	1
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.002	0.0073	0.0123
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Brugia malayi	AMP-binding enzyme family protein	0.0027	0.0528	0.0281
Echinococcus granulosus	phosphatidylinositol 5 phosphate 4 kinase type 2	0.016	0.9541	0.9528
Trypanosoma brucei	unspecified product	0.0026	0.0518	0.044
Echinococcus granulosus	dna polymerase eta	0.0089	0.4746	0.4602
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Trichomonas vaginalis	phosphofructokinase, putative	0.0107	0.5959	1
Brugia malayi	ImpB/MucB/SamB family protein	0.0089	0.4746	0.483
Brugia malayi	RNA binding protein	0.0062	0.2943	0.2885
Brugia malayi	ImpB/MucB/SamB family protein	0.0038	0.1323	0.1138
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0342	0.0284
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0027	0.0528	0.0772
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.3695	0.3522
Schistosoma mansoni	DNA polymerase eta	0.0089	0.4746	0.4602
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0038	0.1323	0.1854
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0073	0.3695	0.3522
Entamoeba histolytica	phosphofructokinase, putative	0.0107	0.5959	1
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0107	0.5959	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.3695	0.6153
Echinococcus granulosus	RUN	0.0024	0.0342	0.0076
Onchocerca volvulus		0.016	0.9541	1
Schistosoma mansoni	rab6-interacting	0.0024	0.0342	0.0076
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0528	0.0772
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0029	0.0683	0.073
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0074	0.3737	0.6096
Loa Loa (eye worm)	TAR-binding protein	0.0062	0.2943	0.3031
Plasmodium falciparum	LCCL domain-containing protein	0.0024	0.0342	0.4407
Loa Loa (eye worm)	6-phosphofructokinase	0.0107	0.5959	0.6217
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0027	0.0528	0.0458
Leishmania major	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2943	0.2749
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0038	0.1323	0.222
Trypanosoma cruzi	DNA polymerase eta, putative	0.0062	0.2958	0.4726
Echinococcus multilocularis	dna polymerase eta	0.0089	0.4746	0.4602
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.016	0.9541	0.9528
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0683	0.1211
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.4876	0.4736
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0062	0.2958	0.7848
Entamoeba histolytica	acyl-coA synthetase, putative	0.0027	0.0528	0.0458
Toxoplasma gondii	aldehyde dehydrogenase	0.0073	0.3695	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	6 phosphofructokinase	0.0107	0.5959	0.5848
Echinococcus multilocularis	6 phosphofructokinase	0.0107	0.5959	0.5848
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.3695	0.6153
Mycobacterium ulcerans	DNA polymerase IV	0.0038	0.1323	0.2123
Trichomonas vaginalis	phosphofructokinase, putative	0.0107	0.5959	1
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0074	0.3737	0.3742
Trypanosoma brucei	DNA polymerase kappa, putative	0.0026	0.0518	0.044
Brugia malayi	TAR-binding protein	0.0062	0.2943	0.2885
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0528	0.048
Loa Loa (eye worm)	RNA binding protein	0.0062	0.2943	0.3031
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Trypanosoma brucei	unspecified product	0.0038	0.1323	0.1854
Loa Loa (eye worm)	6-phosphofructokinase	0.0107	0.5959	0.6217
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0528	0.048
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0107	0.5959	1
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0683	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Leishmania major	ATP-dependent phosphofructokinase	0.0107	0.5959	1
Loa Loa (eye worm)	doublecortin family protein	0.0024	0.0342	0.0284
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0029	0.0683	0.073
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0091	0.4876	0.4736
Echinococcus multilocularis	transcription factor Dp 1	0.0043	0.1628	0.1398
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Echinococcus granulosus	transcription factor Dp 1	0.0043	0.1628	0.1398
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0528	0.048
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0091	0.4876	0.4736
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0091	0.4876	0.5073
Echinococcus multilocularis	RUN	0.0024	0.0342	0.0076
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Loa Loa (eye worm)	pip kinase 2	0.016	0.9541	1
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2943	0.2749
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0027	0.0528	0.0886
Brugia malayi	hypothetical protein	0.0024	0.0342	0.008
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0683	1
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Trypanosoma cruzi	DNA polymerase eta, putative	0.0089	0.4746	0.7869
Mycobacterium ulcerans	6-phosphofructokinase	0.0107	0.5959	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Brugia malayi	6-phosphofructokinase	0.0107	0.5959	0.6138
Trypanosoma brucei	DNA polymerase IV, putative	0.0038	0.1323	0.1854
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0073	0.3695	0.6201
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0027	0.0528	0.0772
Leishmania major	DNA polymerase eta, putative	0.0062	0.2958	0.4726
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	0.2943	0.3031
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0683	0.3934
Trypanosoma brucei	DNA polymerase kappa, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	tar DNA binding protein	0.0062	0.2943	0.2749
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0091	0.4876	0.497
Trypanosoma brucei	DNA polymerase eta, putative	0.0089	0.4746	0.7869
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.3695	0.6153
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0024	0.0342	0.0076
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0074	0.3737	0.3565
Mycobacterium ulcerans	DNA polymerase IV	0.0038	0.1323	0.2123
Plasmodium vivax	multidomain scavenger receptor, putative	0.0024	0.0342	0.4407
Schistosoma mansoni	6-phosphofructokinase	0.0107	0.5959	0.5848
Echinococcus multilocularis	dna polymerase kappa	0.0038	0.1323	0.1084
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.3695	0.3522
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0074	0.3737	0.6096
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0683	0.1211
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.4876	0.4736
Loa Loa (eye worm)	hypothetical protein	0.016	0.9541	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0528	0.0458
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0342	0.0284
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0038	0.1323	0.1084
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0683	0.073
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0027	0.0528	0.0458
Leishmania major	DNA polymerase eta, putative	0.0089	0.4746	0.7869
Brugia malayi	hypothetical protein	0.0024	0.0342	0.008
Mycobacterium ulcerans	hypothetical protein	0.0027	0.0528	0.0772
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0073	0.3695	0.3522
Loa Loa (eye worm)	hypothetical protein	0.0089	0.4746	0.4936
Leishmania major	4-coumarate:coa ligase-like protein	0.0027	0.0528	0.0458
Schistosoma mansoni	rab6-interacting	0.0024	0.0342	0.0076
Mycobacterium ulcerans	acyl-CoA synthetase	0.0027	0.0528	0.0772
Schistosoma mansoni	lipoxygenase	0.0024	0.0342	0.0076
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.016	0.9541	0.9528
Echinococcus granulosus	lipoxygenase domain containing protein	0.0024	0.0342	0.0076
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0067	0.3244	0.3058
Schistosoma mansoni	lipoxygenase	0.0067	0.3244	0.3058
Onchocerca volvulus		0.0027	0.0528	0.0202
Echinococcus multilocularis	phosphatidylinositol 5 phosphate 4 kinase type 2	0.016	0.9541	0.9528
Brugia malayi	phosphofructokinase	0.0107	0.5959	0.6138
Trypanosoma brucei	DNA polymerase IV, putative	0.0038	0.1323	0.1854
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0067	0.3244	0.3058
Trypanosoma brucei	DNA polymerase kappa, putative	0.0026	0.0518	0.044
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0107	0.5959	1
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0073	0.3695	0.6022
Schistosoma mansoni	hypothetical protein	0.0024	0.0342	0.0076
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0091	0.4876	0.4736

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 1 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 50.1187 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory)	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: CHEMBL1553860

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1425198