TDR Targets

Basic information

Technical information

TDR Targets ID: 586171
Name: 1-(4-iodophenyl)-N-isopropyl-propan-2-amine h ydrochloride
MW: 339.643 | Formula: C12H19ClIN
H donors: 1 H acceptors: 0 LogP: 4.44 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CC(Cc1ccc(cc1)I)NC(C)C.Cl
InChi: 1S/C12H18IN.ClH/c1-9(2)14-10(3)8-11-4-6-12(13)7-5-11;/h4-7,9-10,14H,8H2,1-3H3;1H
InChiKey: AFLDFEASYWNJGX-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

1-(4-iodophenyl)-N-isopropyl-2-propanamine hydrochloride
1-(4-iodophenyl)-N-propan-2-yl-propan-2-amine hydrochloride
[2-(4-iodophenyl)-1-methyl-ethyl]-isopropyl-amine hydrochloride
1-(4-iodophenyl)-N-propan-2-ylpropan-2-amine hydrochloride
1-(4-iodophenyl)-N-isopropylpropan-2-amine hydrochloride
85068-76-4
((sup 123)I)(+-)-N-Isopropyl-p-iodoamphetamine hydrochloride
(+-)-p-Iodo-(sup 123)I-N-isopropyl-alpha-methylphenethylamine hydrochloride
Benzeneethanamine, 4-(iodo-(sup 123)I)-alpha-methyl-N-(1-methylethyl)-, hydrochloride, (+-)-
IOFETAMINE HYDROCHLORIDE I-123
Iofetamine I123 hydrochloride
Iofetamine hydrochloride I 123 [USAN]
()-2-(N-Isopropyl)amino-4′-iodophenylpropane
I120_SIGMA
Iofetamine hydrochloride
EU-0100694
1-(4-iodophenyl)propan-2-yl-propan-2-ylazanium chloride
[2-(4-iodophenyl)-1-methyl-ethyl]-isopropyl-ammonium chloride
[2-(4-iodophenyl)-1-methylethyl]-isopropylammonium chloride
1-(4-iodophenyl)propan-2-yl-propan-2-yl-azanium chloride

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	geminin, DNA replication inhibitor	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Homo sapiens	transient receptor potential cation channel, subfamily V, member 1	Starlite/ChEMBL	No references
Homo sapiens	glucosidase, beta, acid	Starlite/ChEMBL	No references
Homo sapiens	potassium voltage-gated channel, subfamily H (eag-related), member 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Loa Loa (eye worm)	voltage and ligand gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus multilocularis	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus granulosus	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Brugia malayi	O-Glycosyl hydrolase family 30 protein	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Onchocerca volvulus	Glucosylceramidase homolog	Get druggable targets OG5_129423	All targets in OG5_129423
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	Potassium voltage-gated channel subfamily H member 2, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Trichomonas vaginalis	glucosylceramidase, putative	Get druggable targets OG5_129423	All targets in OG5_129423
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	Get druggable targets OG5_129423	All targets in OG5_129423

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X	geminin, DNA replication inhibitor	209 aa	176 aa	27.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	hypothetical protein	0.00595864	0.000514298	0.000514298
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Onchocerca volvulus		0.0152985	0.0710217	0.186311
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.0194536	0.102389	0.102389
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0539336	0.362682	1
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.00739164	0.0113321	0.0113321
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.138357	1	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.138357	1	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.00739164	0.0113321	0.0113321
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0539336	0.362682	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Trypanosoma cruzi	hypothetical protein, conserved	0.0159666	0.0760653	1
Brugia malayi	Protein kinase domain containing protein	0.0129495	0.0532889	0.0532889
Brugia malayi	Protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	tyrosine kinase	0.0129495	0.0532889	0.0532889
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0539336	0.362682	1
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Onchocerca volvulus		0.020393	0.109481	0.293607
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00595864	0.000514298	0.000514298
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.0194536	0.102389	0.102389
Schistosoma mansoni	protein tyrosine phosphatase	0.00739164	0.0113321	0.0113321
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.037967	0.242149	0.5
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase 1	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.0259057	0.151097	0.151097
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Brugia malayi	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	insulin receptor	0.0129495	0.0532889	0.0532889
Onchocerca volvulus		0.00703735	0.00865755	0.0123248
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0159666	0.0760653	0.200382
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0159666	0.0760653	0.200382
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Brugia malayi	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0539336	0.362682	0.362682
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.00703735	0.00865755	0.00865755
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase	0.0268452	0.158189	0.158189
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	tyrosine kinase	0.0129495	0.0532889	0.0532889
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Echinococcus multilocularis	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	TK/INSR protein kinase	0.0129495	0.0532889	0.0532889
Schistosoma mansoni	pcd6 interacting protein-related	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.00703735	0.00865755	0.00865755
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00645215	0.00423983	0.00423983
Trypanosoma brucei	low molecular weight protein tyrosine phosphatase, putative	0.0159666	0.0760653	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0539336	0.362682	1
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0539336	0.362682	0.362682
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0539336	0.362682	1
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0539336	0.362682	1
Echinococcus granulosus	insulin receptor	0.0129495	0.0532889	0.0532889
Onchocerca volvulus		0.00703735	0.00865755	0.0123248
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.138357	1	1
Loa Loa (eye worm)	hypothetical protein	0.0194536	0.102389	0.102389
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00739164	0.0113321	0.0113321
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	protein tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.00703735	0.00865755	0.00865755
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.013889	0.0603812	0.0603812
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Loa Loa (eye worm)	hypothetical protein	0.00703735	0.00865755	0.00865755
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.00703735	0.00865755	0.00865755
Loa Loa (eye worm)	hypothetical protein	0.00703735	0.00865755	0.00865755
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0539336	0.362682	1
Brugia malayi	Thrombospondin type 1 domain containing protein	0.0152985	0.0710217	0.0710217
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00645215	0.00423983	0.00423983
Brugia malayi	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein kinase domain containing protein	0.00716346	0.00960961	0.00960961
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.00703735	0.00865755	0.00865755
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.00739164	0.0113321	0.0113321
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0539336	0.362682	0.5
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00739164	0.0113321	0.0113321
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.00645215	0.00423983	0.00423983
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0539336	0.362682	1
Loa Loa (eye worm)	protein tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Onchocerca volvulus		0.0539336	0.362682	1
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00739164	0.0113321	0.0113321
Schistosoma mansoni	hypothetical protein	0.0152985	0.0710217	0.0710217
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.138357	1	1
Echinococcus multilocularis	ectonucleotide	0.00595864	0.000514298	0.000514298
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00739164	0.0113321	0.0113321
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.013889	0.0603812	0.0603812
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	ectonucleotide	0.00595864	0.000514298	0.000514298
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00703735	0.00865755	0.00865755
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.138357	1	1
Leishmania major	hypothetical protein, conserved	0.0159666	0.0760653	1
Brugia malayi	hypothetical protein	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Brugia malayi	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	protein tyrosine phosphatase n9	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Trypanosoma cruzi	hypothetical protein, conserved	0.0159666	0.0760653	1
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00595864	0.000514298	0.000514298
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.00739164	0.0113321	0.0113321
Schistosoma mansoni	protein tyrosine phosphatase	0.00645215	0.00423983	0.00423983
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.00739164	0.0113321	0.0113321
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0152985	0.0710217	0.0710217
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0539336	0.362682	1
Echinococcus multilocularis		0.00645215	0.00423983	0.00423983
Loa Loa (eye worm)	hypothetical protein	0.00705897	0.00882075	0.00882075
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.00703735	0.00865755	0.00865755
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.00645215	0.00423983	0.00423983
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00645215	0.00423983	0.00423983
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.00645215	0.00423983	0.00423983
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.00645215	0.00423983	0.00423983

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= -5.3	Antiplasmodial activity against Plasmodium falciparum W2 after 72 hrs by SYBR green assay	ChEMBL.	19734910
IC50 (functional)	= -5.1	Antiplasmodial activity against Plasmodium falciparum Dd2 after 72 hrs by SYBR green assay	ChEMBL.	19734910
IC50 (functional)	= -5	Antiplasmodial activity against Plasmodium falciparum 3D7 after 72 hrs by SYBR green assay	ChEMBL.	19734910
IC50 (functional)	= -5	Antiplasmodial activity against Plasmodium falciparum 7G8 after 72 hrs by SYBR green assay	ChEMBL.	19734910
IC50 (functional)	= -5	Antiplasmodial activity against Plasmodium falciparum GB4 after 72 hrs by SYBR green assay	ChEMBL.	19734910
IC50 (functional)	= -4.9	Antiplasmodial activity against Plasmodium falciparum HB3 after 72 hrs by SYBR green assay	ChEMBL.	19734910
Potency (functional)	0.0251 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845]	ChEMBL.	No reference
Potency (functional)	0.2909 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	4.6535 uM	PUBCHEM_BIOASSAY: Quantitative high throughput screen for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774]	ChEMBL.	No reference
Potency (functional)	7.0795 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	8.9125 uM	PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of the Human hERG Channel Activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.5893 uM	PUBCHEM_BIOASSAY: HTS Assay for Compounds that Act as Enhancers of the Vanilloid Receptor 1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488988]	ChEMBL.	No reference
Potency (functional)	13.1154 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	18.526 uM	PUBCHEM_BIOASSAY: Quantitative high throughput screen for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488774]	ChEMBL.	No reference
Potency (functional)	19.0115 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	37.6858 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Validation Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) [Related pubchem assays: 1707, 1708 ]	ChEMBL.	No reference
Potency (functional)	= 84.9214 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Human Peripheral Myelin Protein 22 (PMP22) Expression/Activity. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	19734910

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: CHEMBL1255865
PubChem: 55305

Bibliographic References

No literature references available for this target.

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Detailed information for compound 586171