TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 343.395 | Formula: C19H22FN3O2
H donors: 0 H acceptors: 3 LogP: 3.78 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CC1CCCCC1C(=O)N1CC(C1)c1onc(n1)c1cccc(c1)F
InChi: 1S/C19H22FN3O2/c1-12-5-2-3-8-16(12)19(24)23-10-14(11-23)18-21-17(22-25-18)13-6-4-7-15(20)9-13/h4,6-7,9,12,14,16H,2-3,5,8,10-11H2,1H3
InChiKey: HGULSDBPQFERGA-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	glutamate receptor, metabotropic 5	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	Get druggable targets OG5_127095	All targets in OG5_127095
Schistosoma mansoni	metabotropic glutamate receptor	Get druggable targets OG5_127095	All targets in OG5_127095
Schistosoma japonicum	Metabotropic glutamate receptor precursor, putative	Get druggable targets OG5_127095	All targets in OG5_127095
Echinococcus granulosus	metabotropic glutamate receptor 5	Get druggable targets OG5_127095	All targets in OG5_127095
Echinococcus multilocularis	metabotropic glutamate receptor 2	Get druggable targets OG5_127095	All targets in OG5_127095
Schistosoma japonicum	ko:K04606 glutamate receptor, metabotropic 3, putative	Get druggable targets OG5_127095	All targets in OG5_127095
Echinococcus multilocularis	metabotropic glutamate receptor 5	Get druggable targets OG5_127095	All targets in OG5_127095
Brugia malayi	Metabotropic glutamate receptor precursor.	Get druggable targets OG5_127095	All targets in OG5_127095
Echinococcus granulosus	metabotropic glutamate receptor 2	Get druggable targets OG5_127095	All targets in OG5_127095
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_127095	All targets in OG5_127095
Brugia malayi	metabotropic glutamate receptor subtype 5a (mGluR5a), putative	Get druggable targets OG5_127095	All targets in OG5_127095
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127095	All targets in OG5_127095
Loa Loa (eye worm)	glutamate receptor	Get druggable targets OG5_127095	All targets in OG5_127095

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	tar DNA binding protein	0.0064	0.0499	0.0711
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	1
Schistosoma mansoni	camp-dependent protein kinase type II-alpha regulatory subunit	0.0047	0.0141	0.0182
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0071	0.0662	0.0855
Echinococcus granulosus	voltage gated potassium channel	0.0104	0.139	0.1981
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0071	0.0662	0.0593
Loa Loa (eye worm)	pip kinase 2	0.0348	0.6786	0.674
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0335	0.6497	1
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0065	0.0534	0.2204
Loa Loa (eye worm)	hypothetical protein	0.0304	0.5813	0.5753
Brugia malayi	TAR-binding protein	0.0064	0.0499	0.0428
Brugia malayi	Probable ClpP-like protease	0.0085	0.0975	0.0908
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0056	0.0327	0.0466
Schistosoma mansoni	voltage-gated potassium channel	0.0391	0.7746	1
Echinococcus multilocularis	cAMP dependent protein kinase type II regulatory	0.0047	0.0141	0.0201
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0065	0.0534	0.0399
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0064	0.0499	0.0363
Loa Loa (eye worm)	TAR-binding protein	0.0064	0.0499	0.0363
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0358	0.7018	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0096	0.122	0.1739
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0071	0.0662	0.0944
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0499	0.0644
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0057	0.0364	0.0518
Loa Loa (eye worm)	glutamate receptor	0.0049	0.0175	0.0035
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0071	0.0662	0.0529
Loa Loa (eye worm)	hypothetical protein	0.0208	0.3687	0.3597
Schistosoma mansoni	camp-dependent protein kinase type II regulatory subunit	0.0047	0.0141	0.0182
Schistosoma mansoni	voltage-gated potassium channel	0.0391	0.7746	1
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	1
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0071	0.0662	0.0944
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0065	0.0534	0.2204
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0065	0.0534	0.0761
Schistosoma mansoni	camp-dependent rap1 guanine-nucleotide exchange factor	0.0047	0.0141	0.0182
Giardia lamblia	CAMP-dependent protein kinase regulatory chain	0.0047	0.0141	0.5
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0057	0.0364	0.0518
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0304	0.5813	0.5782
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0056	0.0327	0.4735
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0065	0.0534	0.0761
Echinococcus multilocularis	patatin phospholipase domain containing protein	0.0047	0.0141	0.0201
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0096	0.122	0.1155
Echinococcus granulosus	cGMP dependent protein kinase	0.0047	0.0141	0.0201
Plasmodium vivax	ataxin-2 like protein, putative	0.0128	0.1924	1
Toxoplasma gondii	LsmAD domain-containing protein	0.0128	0.1924	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0104	0.139	0.1981
Echinococcus multilocularis	cAMP dependent protein kinase regulatory	0.0047	0.0141	0.0201
Echinococcus multilocularis	phosphatidylinositol 5 phosphate 4 kinase type 2	0.0348	0.6786	0.967
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0065	0.0534	0.2204
Brugia malayi	RNA recognition motif domain containing protein	0.0064	0.0499	0.0428
Schistosoma mansoni	neuropathy target esterase/swiss cheese-related protein	0.0047	0.0141	0.0182
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0085	0.0975	0.4676
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0096	0.122	0.1095
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0071	0.0662	0.0944
Brugia malayi	isocitrate dehydrogenase	0.0065	0.0534	0.0463
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0085	0.0975	0.4676
Brugia malayi	hypothetical protein	0.0128	0.1924	0.1864
Loa Loa (eye worm)	hypothetical protein	0.0311	0.5972	0.5914
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	0.4676
Onchocerca volvulus		0.0348	0.6786	1
Brugia malayi	cAMP-dependent protein kinase regulatory chain, putative	0.0047	0.0141	0.0068
Schistosoma mansoni	voltage-gated potassium channel	0.0057	0.0344	0.0444
Echinococcus granulosus	hyperpolarization activated cyclic	0.0071	0.0662	0.0944
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0085	0.0975	0.1389
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0304	0.5813	0.5782
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0047	0.0141	0.0182
Schistosoma mansoni	neuropathy target esterase/swiss cheese-related protein	0.0047	0.0141	0.0182
Brugia malayi	Isocitrate dehydrogenase	0.0065	0.0534	0.0463
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0071	0.0662	0.0944
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0065	0.0534	0.2204
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0071	0.0662	0.0855
Schistosoma mansoni	60S ribosomal protein L21	0.0057	0.0344	0.0444
Echinococcus granulosus	cAMP dependent protein kinase type II regulatory	0.0047	0.0141	0.0201
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0071	0.0662	0.0944
Loa Loa (eye worm)	hypothetical protein	0.0104	0.139	0.1267
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	0.5
Schistosoma mansoni	camp-dependent protein kinase type I-beta regulatory subunit	0.0047	0.0141	0.0182
Echinococcus multilocularis	cGMP dependent protein kinase 1	0.0047	0.0141	0.0201
Schistosoma mansoni	similar to Protein C20orf152 homolog	0.0047	0.0141	0.0182
Plasmodium falciparum	ataxin-2 like protein, putative	0.0128	0.1924	1
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0662	0.0529
Brugia malayi	Egg laying defective protein 4	0.0047	0.0141	0.0068
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0065	0.0534	0.2204
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0141	0.0182
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0358	0.7018	1
Schistosoma mansoni	camp-dependent protein kinase type I-beta regulatory subunit	0.0047	0.0141	0.0182
Schistosoma mansoni	hypothetical protein	0.0096	0.122	0.1575
Echinococcus multilocularis	tar DNA binding protein	0.0064	0.0499	0.0711
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0065	0.0534	0.2204
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0348	0.6786	0.8761
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0071	0.0662	0.082
Brugia malayi	Latrophilin receptor protein 2	0.0096	0.122	0.1155
Toxoplasma gondii	isocitrate dehydrogenase	0.0065	0.0534	0.2204
Echinococcus granulosus	metabotropic glutamate receptor 5	0.006	0.0425	0.0606
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.0065	0.0534	1
Schistosoma mansoni	hypothetical protein	0.0096	0.122	0.1575
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0071	0.0662	0.0855
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0056	0.0327	0.2231
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0071	0.0662	0.0944
Loa Loa (eye worm)	RNA binding protein	0.0064	0.0499	0.0363
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0104	0.139	0.1326
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0047	0.0141	0.0201
Schistosoma mansoni	hypothetical protein	0.0096	0.122	0.1575
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0047	0.0141	0.0182
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0056	0.0327	0.4735
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0358	0.7018	0.6996
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0071	0.0662	0.0529
Brugia malayi	Hypothetical UPF0028 protein ZK370.4 in chromosome III, putative	0.0047	0.0141	0.0068
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0096	0.122	0.1739
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0104	0.139	0.1981
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.006	0.0425	0.0606
Schistosoma mansoni	voltage-gated potassium channel	0.0071	0.0662	0.0855
Brugia malayi	Pip kinase protein 2	0.0348	0.6786	0.6762
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0499	0.0644
Echinococcus granulosus	patatin phospholipase domain containing protein	0.0047	0.0141	0.0201
Schistosoma mansoni	peptidase Clp (S14 family)	0.0085	0.0975	0.1258
Plasmodium falciparum	ataxin-2 like protein, putative	0.0128	0.1924	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0128	0.1924	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0085	0.0975	1
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0065	0.0534	0.2204
Trypanosoma brucei	PAB1-binding protein , putative	0.0128	0.1924	1
Echinococcus multilocularis	GPCR, family 2	0.0096	0.122	0.1739
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0047	0.0141	0.0201
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0071	0.0662	0.0944
Schistosoma mansoni	metabotropic glutamate receptor 2 3 (mglur group 2)	0.0056	0.0324	0.0418
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0071	0.0662	0.082
Schistosoma mansoni	cyclic nucleotide-gated ion channel	0.0047	0.0141	0.0182
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0304	0.5813	0.5753
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0065	0.0534	0.0761
Echinococcus granulosus	cAMP dependent protein kinase regulatory	0.0047	0.0141	0.0201
Trypanosoma cruzi	PAB1-binding protein , putative	0.0128	0.1924	1
Brugia malayi	Metabotropic glutamate receptor precursor.	0.0049	0.0175	0.0102
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0499	0.0644
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0335	0.6497	1
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	1
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0975	0.0846
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0047	0.0141	0.0201
Schistosoma mansoni	voltage-gated potassium channel	0.0104	0.139	0.1795
Schistosoma mansoni	phosphatidylinositol-4-phosphate 5-kinase type II	0.0348	0.6786	0.8761
Echinococcus multilocularis	cGMP dependent protein kinase 1	0.0047	0.0141	0.0201
Loa Loa (eye worm)	hypothetical protein	0.006	0.0425	0.0288
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0065	0.0534	0.0761
Echinococcus granulosus	cAMP dependent protein kinase type I beta	0.0047	0.0141	0.0201
Echinococcus granulosus	GPCR family 2	0.0096	0.122	0.1739
Schistosoma mansoni	camp-dependent protein kinase regulatory chain	0.0047	0.0141	0.0182
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0096	0.122	0.1739
Echinococcus multilocularis	expressed conserved protein	0.0047	0.0141	0.0201
Brugia malayi	N-terminal motif family protein	0.0047	0.0141	0.0068
Schistosoma mansoni	hypothetical protein	0.0047	0.0141	0.0182
Loa Loa (eye worm)	hypothetical protein	0.0348	0.6786	0.674
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0071	0.0662	0.0944
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0071	0.0662	0.0855
Brugia malayi	Cyclic-nucleotide gated cation channel, C. elegans tax-4 ortholog	0.0047	0.0141	0.0068
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0358	0.7018	0.6975
Schistosoma mansoni	hypothetical protein	0.0208	0.3687	0.476
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0499	0.0644
Brugia malayi	hypothetical protein	0.0083	0.0921	0.0854
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0141	0.0182
Leishmania major	hypothetical protein, conserved	0.0128	0.1924	1
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0085	0.0975	0.4676
Schistosoma mansoni	voltage-gated potassium channel	0.0104	0.139	0.1795
Echinococcus granulosus	peptidase Clp S14 family	0.0056	0.0327	0.0466
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0047	0.0141	0.0201
Toxoplasma gondii	isocitrate dehydrogenase	0.0065	0.0534	0.2204
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0096	0.122	0.1739
Echinococcus granulosus	phosphatidylinositol 5 phosphate 4 kinase type 2	0.0348	0.6786	0.967
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1924	0.1809
Brugia malayi	RNA binding protein	0.0064	0.0499	0.0428
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0065	0.0534	0.0689
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0085	0.0975	0.1389
Echinococcus granulosus	hyperpolarization activated cyclic	0.0071	0.0662	0.0944
Echinococcus multilocularis	cAMP dependent protein kinase type I beta	0.0047	0.0141	0.0201
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0071	0.0662	0.0855
Schistosoma mansoni	hypothetical protein	0.0057	0.0364	0.0469
Echinococcus multilocularis	voltage gated potassium channel	0.0104	0.139	0.1981
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0071	0.0662	0.0944
Schistosoma mansoni	hypothetical protein	0.0096	0.122	0.1575
Schistosoma mansoni	tar DNA-binding protein	0.0064	0.0499	0.0644
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0085	0.0975	1
Loa Loa (eye worm)	hypothetical protein	0.0096	0.122	0.1095
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0141	0.0182
Echinococcus multilocularis	isocitrate dehydrogenase	0.0065	0.0534	0.0761
Brugia malayi	latrophilin 2 splice variant baaae	0.0208	0.3687	0.364
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0047	0.0141	0.0201
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0065	0.0534	0.0761

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (binding)	= 48 %	Positive allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay	ChEMBL.	22975301
EC50 (binding)	= 540 nM	Positive allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay	ChEMBL.	22975301
Emax (binding)	= 87 %	Positive allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay	ChEMBL.	22975301
IC50 (ADMET)	= 25 mM	Inhibition of CYP3A4	ChEMBL.	22975301
IC50 (ADMET)	= 40 mM	Inhibition of CYP2D6	ChEMBL.	22975301
IC50 (binding)	> 10000 nM	Negative allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay	ChEMBL.	22975301
PPB (ADMET)	= 96.6 %	Plasma protein binding in human	ChEMBL.	22975301

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: CHEMBL2151616

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1723904