TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 413.851 | Formula: C22H20ClNO5
H donors: 0 H acceptors: 3 LogP: 3.28 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)[C@]12Cc3c([C@H]1N(CC(=O)OC)C(=O)c1c2cccc1)ccc(c3)Cl
InChi: 1S/C22H20ClNO5/c1-3-29-21(27)22-11-13-10-14(23)8-9-15(13)19(22)24(12-18(25)28-2)20(26)16-6-4-5-7-17(16)22/h4-10,19H,3,11-12H2,1-2H3/t19-,22+/m1/s1
InChiKey: VPARFQWPEZIXAX-KNQAVFIVSA-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	polo-like kinase 1	Starlite/ChEMBL	No references
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	isocitrate dehydrogenase 1 (NADP+), soluble	Starlite/ChEMBL	No references
Homo sapiens	synuclein, alpha (non A4 component of amyloid precursor)	Starlite/ChEMBL	No references
Homo sapiens	ataxin 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma brucei gambiense	polo-like protein kinase,protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Plasmodium knowlesi	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Loa Loa (eye worm)	PLK/PLK1 protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Entamoeba histolytica	serine/threonine protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Babesia bovis	isocitrate dehydrogenase, NADP-dependent family protein	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Plasmodium berghei	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Theileria parva	isocitrate dehydrogenase (NADP+), putative	Get druggable targets OG5_127057	All targets in OG5_127057
Neospora caninum	hypothetical protein	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma japonicum	Serine/threonine-protein kinase PLK1, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Brugia malayi	Isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	C terminus of cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Neospora caninum	Isocitrate dehydrogenase-like protein, related	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma congolense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma japonicum	ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma cruzi	polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma brucei gambiense	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma japonicum	ko:K06631 polo-like kinase 1, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma brucei gambiense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	protein serine/threonine kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania mexicana	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Toxoplasma gondii	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma brucei	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania mexicana	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium yoelii	isocitrate dehydrogenase, NADP-dependent, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	Mitochondrial NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Onchocerca volvulus	Serine\/threonine kinase homolog	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania infantum	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania donovani	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma brucei	polo-like protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	Get druggable targets OG5_127057	All targets in OG5_127057
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma cruzi	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma congolense	protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Candida albicans	cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Brugia malayi	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma cruzi	polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania braziliensis	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Plasmodium yoelii	isocitrate dehydrogenase, NADP-dependent	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus granulosus	serine:threonine protein kinase PLK1	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Brugia malayi	serine/threonine-protein kinase plk-2	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Toxoplasma gondii	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Candida albicans	protein serine/threonine kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania braziliensis	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania infantum	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Candida albicans	Mitochondrial NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Giardia lamblia	Kinase, PLK	Get druggable targets OG5_127396	All targets in OG5_127396
Candida albicans	N terminus of cytosolic NADP-specific isocitrate dehydrogenase.	Get druggable targets OG5_127057	All targets in OG5_127057
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	Get druggable targets OG5_127057	All targets in OG5_127057
Loa Loa (eye worm)	isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Trypanosoma congolense	isocitrate dehydrogenase, putative	Get druggable targets OG5_127057	All targets in OG5_127057
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	Get druggable targets OG5_127057	All targets in OG5_127057
Echinococcus multilocularis	serine:threonine protein kinase PLK1	Get druggable targets OG5_127396	All targets in OG5_127396

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 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0114	0.5567	0.5567
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Brugia malayi	Delta serrate ligand family protein	0.0058	0.1859	0.1859
Schistosoma mansoni	peroxidasin	0.0181	1	1
Onchocerca volvulus		0.0181	1	1
Loa Loa (eye worm)	blistered cuticle protein 3	0.0181	1	1
Schistosoma mansoni	laminin gamma-3 chain	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Onchocerca volvulus	Peroxidase homolog	0.0181	1	1
Brugia malayi	Animal haem peroxidase family protein	0.0181	1	1
Brugia malayi	Blistered cuticle protein 3	0.0181	1	1
Schistosoma mansoni	septate junction protein	0.0058	0.1859	0.1234
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.0713	0.0713
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0713	0.0713
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Onchocerca volvulus	Peroxidase homolog	0.0181	1	1
Schistosoma mansoni	lipoxygenase	0.0096	0.4337	0.3903
Brugia malayi	Cadherin domain containing protein	0.0058	0.1859	0.1859
Brugia malayi	Muscle positioning protein 4	0.0058	0.1859	0.1859
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Trypanosoma cruzi	polo-like protein kinase, putative	0.0114	0.5567	1
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Loa Loa (eye worm)	animal heme peroxidase	0.0181	1	1
Echinococcus multilocularis	peroxidasin	0.0181	1	1
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0137	0.7076	0.6409
Brugia malayi	Animal haem peroxidase family protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0	0.5
Loa Loa (eye worm)	animal heme peroxidase	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Trypanosoma cruzi	polo-like protein kinase, putative	0.0114	0.5567	1
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0137	0.7076	0.6409
Brugia malayi	Peroxidasin	0.0181	1	1
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Onchocerca volvulus		0.0181	1	1
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Schistosoma mansoni	serine/threonine protein kinase	0.0114	0.5567	0.5226
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.006	0.1981	0.1981
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0	0.5
Onchocerca volvulus		0.0181	1	1
Brugia malayi	Animal haem peroxidase family protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Brugia malayi	Animal haem peroxidase family protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Schistosoma mansoni	slit	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Echinococcus granulosus	peroxidasin	0.0181	1	1
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0	0.5
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0058	0.1859	0.1859
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0114	0.5567	1
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Brugia malayi	notch-like transmembrane receptor	0.0058	0.1859	0.1859
Loa Loa (eye worm)	animal heme peroxidase	0.0181	1	1
Schistosoma mansoni	kinase	0.0058	0.1833	0.1206
Schistosoma mansoni	peroxidasin	0.0181	1	1
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.1981	0.1981
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Giardia lamblia	Kinase, PLK	0.0114	0.5567	1
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Onchocerca volvulus	Chorion peroxidase homolog	0.0181	1	1
Onchocerca volvulus	Peroxidasin homolog	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Onchocerca volvulus	Peroxidasin homolog	0.0181	1	1
Brugia malayi	serine/threonine-protein kinase plk-2	0.0114	0.5567	0.5567
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Brugia malayi	Calcium binding EGF domain containing protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Loa Loa (eye worm)	animal heme peroxidase	0.0181	1	1
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0114	0.5567	0.5
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0114	0.5567	0.4554
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.1981	0.1981
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0114	0.5567	0.4554
Brugia malayi	Calcium binding EGF domain containing protein	0.0058	0.1859	0.1859
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.0058	0.1859	0.1234
Brugia malayi	GCC2 and GCC3 family protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	Notch2	0.0058	0.1859	0.1859
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.5567	1
Brugia malayi	Cadherin domain containing protein	0.0058	0.1859	0.1859
Brugia malayi	Animal haem peroxidase family protein	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Loa Loa (eye worm)	hypothetical protein	0.0181	1	1
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.1981	0.1981
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Loa Loa (eye worm)	notch protein	0.0058	0.1859	0.1859
Schistosoma mansoni	notch	0.0058	0.1859	0.1234
Schistosoma mansoni	cell polarity protein	0.0058	0.1859	0.1234
Toxoplasma gondii	EGF family domain-containing protein	0.0058	0.1859	1
Trypanosoma brucei	polo-like protein kinase	0.0114	0.5567	1
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0114	0.5567	0.4554
Brugia malayi	Calcium binding EGF domain containing protein	0.0058	0.1859	0.1859
Schistosoma mansoni	hypothetical protein	0.0058	0.1859	0.1234
Onchocerca volvulus	Dual oxidase homolog	0.0181	1	1
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859
Brugia malayi	EGF-like domain containing protein	0.0058	0.1859	0.1859
Schistosoma mansoni	lipoxygenase	0.0137	0.7076	0.6852
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1859	0.1859

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	4.2284 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.8048 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)	7.9433 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	7.9433 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	15.8489 uM	PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	31.6228 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	44.6684 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (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: CHEMBL2143799

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1701304