TDR Targets

Basic information

Technical information

TDR Targets ID: 1483414
Name: (4-bromophenyl)-(7-methyl-2,3,4,7,9,10-hexahy dro-[1,4]dioxepino[2,3-g]isoquinolin-8-yl)met hanone
MW: 402.282 | Formula: C20H20BrNO3
H donors: 0 H acceptors: 1 LogP: 4.08 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: Brc1ccc(cc1)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1
InChi: 1S/C20H20BrNO3/c1-13-17-12-19-18(24-9-2-10-25-19)11-15(17)7-8-22(13)20(23)14-3-5-16(21)6-4-14/h3-6,11-13H,2,7-10H2,1H3
InChiKey: KOKJLCFIBUUHDN-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references
Homo sapiens	SMAD family member 2	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	MH2 domain-containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Brugia malayi	MH2 domain containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	transcription factor SMAD2	Get druggable targets OG5_131716	All targets in OG5_131716
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %
Brugia malayi	MH2 domain containing protein	SMAD family member 2	467 aa	405 aa	31.6 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.1567	0.4104	0.4104
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0143	0.0273	0.0236
Schistosoma mansoni	protein tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0143	0.0273	0.0236
Brugia malayi	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.1567	0.4104	0.5
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0143	0.0273	0.0236
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.1567	0.4104	0.4104
Loa Loa (eye worm)	hypothetical protein	0.0196	0.0418	0.0418
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0153	0.03	0.0263
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0153	0.03	0.0263
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0153	0.03	0.0263
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0153	0.03	0.0263
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0153	0.03	0.0263
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0143	0.0273	0.0273
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0503	0.1243	0.1243
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0143	0.0273	0.0236
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.3758	1	1
Trypanosoma brucei	protein tyrosine phosphatase 1	0.0143	0.0273	0.0078
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.0143	0.0273	0.0236
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Brugia malayi	MH2 domain containing protein	0.0144	0.0277	0.0277
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0158	0.0314	0.0314
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0143	0.0273	0.0078
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.0143	0.0273	0.0273
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.1084	0.2805	0.5
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0196	0.0418	0.0381
Echinococcus granulosus	ectonucleotide	0.0196	0.0418	0.0381
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Onchocerca volvulus		0.1567	0.4104	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0233	0.0516	0.0516
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Schistosoma mansoni	endonuclease related	0.014	0.0266	0.0266
Schistosoma mansoni	protein tyrosine phosphatase	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.3758	1	1
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0158	0.0314	0.0314
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1567	0.4104	1
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase 1	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.03	0.0698	0.0698
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1567	0.4104	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0144	0.0277	0.0277
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0143	0.0273	0.0078
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0143	0.0273	0.0273
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.0143	0.0273	0.0273
Leishmania major	hypothetical protein, conserved	0.0483	0.1189	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0153	0.03	0.0263
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Brugia malayi	hypothetical protein	0.0143	0.0273	0.0273
Leishmania major	protein-tyrosine phosphatase 1-like protein	0.0143	0.0273	0.0078
Echinococcus multilocularis		0.0143	0.0273	0.0236
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0153	0.03	0.03
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0038	0.0038
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0153	0.03	0.0263
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.1567	0.4104	1
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0196	0.0418	0.0381
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.0143	0.0273	0.0273
Trypanosoma cruzi	hypothetical protein, conserved	0.0483	0.1189	1
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Onchocerca volvulus		0.0233	0.0516	0.0635
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Onchocerca volvulus		0.0168	0.0341	0.0177
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0153	0.03	0.03
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1567	0.4104	1
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0233	0.0516	0.0516
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.3758	1	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0038	0.0038
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.0051	0.0051
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.3758	1	1
Loa Loa (eye worm)	hypothetical protein	0.0233	0.0516	0.0516
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.1567	0.4104	1
Echinococcus granulosus	protein tyrosine phosphatase n9	0.0143	0.0273	0.0236
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0233	0.0516	0.0516
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1567	0.4104	1
Leishmania major	tyrosine specific protein phosphatase, putative	0.0143	0.0273	0.0078
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0038	0.0038
Trypanosoma brucei	low molecular weight protein tyrosine phosphatase, putative	0.0483	0.1189	1
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0233	0.0516	0.0516
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0979	0.2524	0.2495
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0038	0.0038
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0158	0.0314	0.0314
Echinococcus multilocularis	hypothetical protein	0.0143	0.0273	0.0236
Brugia malayi	endonuclease G, mitochondrial precursor	0.014	0.0266	0.0266
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0483	0.1189	0.2389
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0143	0.0273	0.0236
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0153	0.03	0.03
Echinococcus granulosus	Endonuclease G	0.014	0.0266	0.0229
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Schistosoma mansoni	hypothetical protein	0.0503	0.1243	0.1243
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0483	0.1189	0.2389
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0153	0.03	0.03
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0153	0.03	0.03
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0233	0.0516	0.0516
Trypanosoma cruzi	hypothetical protein, conserved	0.0483	0.1189	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0153	0.03	0.0263
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.0153	0.03	0.03
Onchocerca volvulus		0.0503	0.1243	0.2531
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0143	0.0273	0.0273
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.006	0.0051	0.0051
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0153	0.03	0.0263
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.0051	0.0051
Brugia malayi	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	transcription factor SMAD2	0.0144	0.0277	0.0277
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0143	0.0273	0.0236
Brugia malayi	hypothetical protein	0.0143	0.0273	0.0273
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0143	0.0273	0.0078
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1567	0.4104	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Echinococcus multilocularis	Endonuclease G	0.014	0.0266	0.0229
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0143	0.0273	0.0236
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.0051	0.0051
Onchocerca volvulus		0.0233	0.0516	0.0635
Brugia malayi	Protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Brugia malayi	hypothetical protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0143	0.0273	0.0273
Schistosoma mansoni	protein tyrosine phosphatase	0.0153	0.03	0.03
Schistosoma mansoni	pcd6 interacting protein-related	0.0143	0.0273	0.0273
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0038	0.0038
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Toxoplasma gondii	DNA/RNA non-specific endonuclease	0.014	0.0266	0.5
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0233	0.0516	0.0516
Brugia malayi	Thrombospondin type 1 domain containing protein	0.0503	0.1243	0.1243
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0143	0.0273	0.0236
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0233	0.0516	0.048
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0143	0.0273	0.0273
Echinococcus multilocularis	ectonucleotide	0.0196	0.0418	0.0381
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1567	0.4104	1
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.1567	0.4104	1
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0143	0.0273	0.0236
Loa Loa (eye worm)	protein tyrosine phosphatase	0.0143	0.0273	0.0273
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.0143	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0233	0.0516	0.0516
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0143	0.0273	0.0273
Brugia malayi	Protein-tyrosine phosphatase	0.0311	0.0725	0.0725
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.0143	0.0273	0.0273
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0153	0.03	0.0263

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	3.1623 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.99 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	14.1254 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	18.526 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)	19.9526 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	23.1093 uM	PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	56.2341 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference
Potency (functional)	100 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

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23
Plasmodium falciparum	ChEMBL23

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: CHEMBL1720590

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1483414