TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 252.353 | Formula: C14H24N2O2
H donors: 1 H acceptors: 1 LogP: 3.51 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CC(C1(C)OC(=NC1=O)NC1CCCCCC1)C
InChi: 1S/C14H24N2O2/c1-10(2)14(3)12(17)16-13(18-14)15-11-8-6-4-5-7-9-11/h10-11H,4-9H2,1-3H3,(H,15,16,17)
InChiKey: BHQAPEMYHALQKW-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	hydroxysteroid (11-beta) dehydrogenase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium tuberculosis	Probable oxidoreductase	Get druggable targets OG5_132866	All targets in OG5_132866
Mycobacterium ulcerans	short chain dehydrogenase	Get druggable targets OG5_132866	All targets in OG5_132866

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	steroid dehydrogenase, putative	hydroxysteroid (11-beta) dehydrogenase 1	292 aa	250 aa	24.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	aminopeptidase P1 (M24 family)	0.0077	0.0875	0.0875
Entamoeba histolytica	methionine aminopeptidase, putative	0.0594	1	1
Brugia malayi	neuropeptide F receptor	0.0043	0.0282	0.0282
Brugia malayi	Methionine aminopeptidase protein type I	0.0119	0.1623	0.1623
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0043	0.0282	0.0282
Mycobacterium leprae	PROBABLE METHIONINE AMINOPEPTIDASE MAPB (MAP) (PEPTIDASE M)	0.0103	0.1325	1
Plasmodium falciparum	methionine aminopeptidase 1a, putative	0.0103	0.1325	0.0493
Echinococcus multilocularis	neuropeptide receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptides capa receptor	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0043	0.0282	0.0282
Echinococcus granulosus	somatostatin receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	xaa Pro dipeptidase	0.0077	0.0875	0.0875
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	Dopamine receptor protein 2	0.0043	0.0282	0.0282
Mycobacterium ulcerans	methionine aminopeptidase	0.0103	0.1325	0.0978
Trypanosoma cruzi	metallo-peptidase, Clan MG, Family M24	0.0594	1	1
Echinococcus granulosus	methionyl aminopeptidase 1 M24 family	0.0119	0.1623	0.1623
Brugia malayi	metallopeptidase family M24 containing protein	0.0077	0.0875	0.0875
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	neuropeptide receptor A26	0.0043	0.0282	0.0282
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	G protein coupled receptor 139	0.0043	0.0282	0.0282
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0043	0.0282	0.0282
Plasmodium falciparum	methionine aminopeptidase 2	0.0594	1	1
Echinococcus granulosus	g-protein coupled receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0043	0.0282	0.0282
Schistosoma mansoni	myosin xvIII	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0043	0.0282	0.0282
Trypanosoma brucei	methionine aminopeptidase 2, putative	0.0594	1	1
Loa Loa (eye worm)	initiation factor 2-associated protein	0.0594	1	1
Wolbachia endosymbiont of Brugia malayi	methionine aminopeptidase	0.0103	0.1325	1
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Brugia malayi	Dopamine receptor	0.0043	0.0282	0.0282
Brugia malayi	metallopeptidase family M24 containing protein	0.0077	0.0875	0.0875
Echinococcus multilocularis	Proliferation associated protein 2G4	0.0077	0.0875	0.0875
Schistosoma mansoni	amine GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	xaa pro aminopeptidase	0.0077	0.0875	0.0875
Brugia malayi	putative neuropeptide receptor NPR1	0.0043	0.0282	0.0282
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0043	0.0282	0.0282
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0043	0.0282	0.0282
Mycobacterium ulcerans	methionine aminopeptidase MapB	0.0103	0.1325	0.0978
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	tm gpcr rhodopsin	0.0043	0.0282	0.0282
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0043	0.0282	0.0282
Toxoplasma gondii	methionine aminopeptidase 2, putative	0.0594	1	1
Entamoeba histolytica	aminopeptidase, putative	0.0077	0.0875	0.0875
Schistosoma mansoni	peptidase	0.0077	0.0875	0.0875
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0043	0.0282	0.0282
Schistosoma mansoni	opsin-like receptor	0.0043	0.0282	0.0282
Leishmania major	methionine aminopeptidase 2, putative	0.0594	1	1
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0043	0.0282	0.0282
Echinococcus multilocularis	fmrfamide receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptide FF receptor 2	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	neuropeptide receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	g protein coupled receptor	0.0043	0.0282	0.0282
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0043	0.0282	0.0282
Brugia malayi	neuropeptide F receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Mycobacterium ulcerans	short chain dehydrogenase	0.0338	0.5479	1
Schistosoma mansoni	proliferation-associated protein 2G4 38kDa (M24 family)	0.0077	0.0875	0.0875
Schistosoma mansoni	methionyl aminopeptidase 1 (M24 family)	0.0103	0.1325	0.1325
Echinococcus granulosus	xaa pro aminopeptidase	0.0077	0.0875	0.0875
Echinococcus multilocularis	orexin receptor type 2	0.0043	0.0282	0.0282
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0875	0.061
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0043	0.0282	0.0282
Schistosoma mansoni	amine GPCR	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus multilocularis	neuropeptide receptor	0.0043	0.0282	0.0282
Chlamydia trachomatis	methionine aminopeptidase	0.0103	0.1325	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0338	0.5479	1
Echinococcus granulosus	neuropeptide Y receptor	0.0043	0.0282	0.0282
Brugia malayi	putative neuropeptide receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	g protein coupled receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	neuropeptide receptor	0.0043	0.0282	0.0282
Brugia malayi	G protein-coupled receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	orexin receptor type 2	0.0043	0.0282	0.0282
Plasmodium vivax	methionine aminopeptidase 1a, putative	0.0103	0.1325	0.0493
Echinococcus granulosus	fmrfamide receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	xaa Pro dipeptidase	0.0077	0.0875	0.0875
Schistosoma mansoni	neuropeptide F-like receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptide Y receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	amine GPCR	0.0043	0.0282	0.0282
Brugia malayi	follicle stimulating hormone receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	Xaa Pro aminopeptidase 3	0.0077	0.0875	0.0875
Trichomonas vaginalis	Clan MG, familly M24, aminopeptidase P-like metallopeptidase	0.0594	1	1
Trypanosoma brucei	metallo-peptidase, Clan MG, Family M24	0.0594	1	1
Echinococcus granulosus	neuropeptide receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	tm gpcr rhodopsin	0.0043	0.0282	0.0282
Echinococcus multilocularis	fmrfamide receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0043	0.0282	0.0282
Schistosoma mansoni	neuropeptide F-like receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	g protein coupled receptor	0.0043	0.0282	0.0282
Loa Loa (eye worm)	methionine aminopeptidase type I	0.0119	0.1623	0.138
Echinococcus multilocularis	g protein coupled receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	G protein coupled receptor 139	0.0043	0.0282	0.0282
Mycobacterium tuberculosis	Methionine aminopeptidase MapA (map) (peptidase M) (MetAP)	0.0103	0.1325	0.0978
Echinococcus granulosus	7TM GPCR rhodopsin	0.0043	0.0282	0.0282
Trypanosoma cruzi	metallo-peptidase, Clan MG, Family M24	0.0594	1	1
Echinococcus granulosus	7tm_1 domain containing protein	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Mycobacterium tuberculosis	Methionine aminopeptidase MapB (map) (peptidase M)	0.0103	0.1325	0.0978
Echinococcus multilocularis	g protein coupled receptor	0.0043	0.0282	0.0282
Brugia malayi	GnHR receptor homolog	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus granulosus	methionine aminopeptidase type I	0.0077	0.0875	0.0875
Trypanosoma brucei	methionine aminopeptidase, putative	0.0119	0.1623	0.082
Echinococcus multilocularis	sex peptide receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	methionine aminopeptidase, type I	0.0077	0.0875	0.0875
Echinococcus granulosus	sex peptide receptor	0.0043	0.0282	0.0282
Treponema pallidum	methionine aminopeptidase (map)	0.0103	0.1325	1
Trichomonas vaginalis	Clan MG, familly M24, aminopeptidase P-like metallopeptidase	0.0594	1	1
Schistosoma mansoni	biogenic amine receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	histamine h1 receptor	0.0043	0.0282	0.0282
Brugia malayi	ORL1-like opioid receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	G-protein coupled receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	g protein coupled receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	methionyl aminopeptidase 2	0.0594	1	1
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	opsin-like receptor	0.0043	0.0282	0.0282
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0043	0.0282	0.0282
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	neuropeptide receptor	0.0043	0.0282	0.0282
Giardia lamblia	Methionine aminopeptidase	0.0594	1	1
Echinococcus granulosus	Xaa Pro aminopeptidase 3	0.0077	0.0875	0.0875
Trypanosoma cruzi	metallo- peptidase, Clan MG, Family M24	0.0119	0.1623	0.082
Brugia malayi	Serotonin receptor	0.0043	0.0282	0.0282
Brugia malayi	Serotonin receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	AKH receptor	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus multilocularis	serotonin receptor	0.0043	0.0282	0.0282
Leishmania major	methionine aminopeptidase, putative,metallo-peptidase, Clan MG, Family M24	0.0119	0.1623	0.082
Brugia malayi	G-protein coupled receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	biogenic amine 5HT receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Onchocerca volvulus	FACT complex subunit SPT16 homolog	0.0077	0.0875	0.061
Brugia malayi	metallopeptidase family M24 containing protein	0.0077	0.0875	0.0875
Echinococcus granulosus	dro:myosuppressin receptor	0.0043	0.0282	0.0282
Brugia malayi	Melatonin receptor type 1A	0.0043	0.0282	0.0282
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	somatostatin receptor	0.0043	0.0282	0.0282
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0875	0.061
Schistosoma mansoni	neuropeptide receptor	0.0043	0.0282	0.0282
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0875	0.061
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0043	0.0282	0.0282
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	FACT complex subunit SPT16	0.0077	0.0875	0.0875
Echinococcus multilocularis	methionyl aminopeptidase 1 (M24 family)	0.0103	0.1325	0.1325
Onchocerca volvulus		0.0077	0.0875	0.061
Echinococcus multilocularis	neuropeptide s receptor	0.0043	0.0282	0.0282
Plasmodium vivax	methionine aminopeptidase 1b, putative	0.0119	0.1623	0.082
Brugia malayi	DNA-binding protein, 42 kDa containing protein	0.0077	0.0875	0.0875
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Schistosoma mansoni	aminopeptidase P homologue (M24 family)	0.0077	0.0875	0.0875
Echinococcus granulosus	neuropeptides capa receptor	0.0043	0.0282	0.0282
Toxoplasma gondii	methionine aminopeptidase	0.0103	0.1325	0.0493
Loa Loa (eye worm)	metallopeptidase family M24 containing protein	0.0077	0.0875	0.061
Loa Loa (eye worm)	DNA-binding protein	0.0077	0.0875	0.061
Echinococcus multilocularis	serotonin receptor	0.0043	0.0282	0.0282
Mycobacterium leprae	PROBABLE METHIONINE AMINOPEPTIDASE MAPA (MAP) (PEPTIDASE M) (MetAP)	0.0103	0.1325	1
Plasmodium vivax	methionine aminopeptidase 2, putative	0.0594	1	1
Entamoeba histolytica	peptidase, putative	0.0077	0.0875	0.0875
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	amine GPCR	0.0043	0.0282	0.0282
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	growth hormone secretagogue receptor	0.0043	0.0282	0.0282
Onchocerca volvulus	Dipeptidase C homolog	0.0077	0.0875	0.061
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	neuropeptides capa receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	serotonin receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	tm gpcr rhodopsin	0.0043	0.0282	0.0282
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	opsin-like receptor	0.0043	0.0282	0.0282
Brugia malayi	Dopamine receptor protein 1	0.0043	0.0282	0.0282
Schistosoma mansoni	chromatin-specific transcription elongation factor 140 kDa subunit (M24 family)	0.0077	0.0875	0.0875
Echinococcus multilocularis	neuropeptide Y receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0043	0.0282	0.0282
Trypanosoma brucei	methionine aminopeptidase, type I, putative	0.0119	0.1623	0.082
Schistosoma mansoni	biogenic amine receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	xaa Pro dipeptidase	0.0077	0.0875	0.0875
Trypanosoma brucei	metallo- peptidase, Clan MG, Family M24	0.0119	0.1623	0.082
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0043	0.0282	0.0282
Schistosoma mansoni	biogenic amine receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0043	0.0282	0.0282
Trichomonas vaginalis	Clan MG, familly M24, aminopeptidase P-like metallopeptidase	0.0594	1	1
Echinococcus granulosus	xaa Pro dipeptidase	0.0077	0.0875	0.0875
Echinococcus granulosus	allatostatin A receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	dro:myosuppressin receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Brugia malayi	sulfakinin receptor protein	0.0043	0.0282	0.0282
Schistosoma mansoni	Xaa-Pro dipeptidase (M24 family)	0.0077	0.0875	0.0875
Brugia malayi	RE15519p	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptide s receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptide receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	amine GPCR	0.0043	0.0282	0.0282
Plasmodium falciparum	methionine aminopeptidase 1b, putative	0.0119	0.1623	0.082
Echinococcus multilocularis	neuropeptide Y receptor	0.0043	0.0282	0.0282
Schistosoma mansoni	adenoreceptor	0.0043	0.0282	0.0282
Schistosoma mansoni	methionyl aminopeptidase 1 (M24 family)	0.0103	0.1325	0.1325
Echinococcus granulosus	Proliferation associated protein 2G4	0.0077	0.0875	0.0875
Schistosoma mansoni	proliferation-associated protein 2G4 38kDa (M24 family)	0.0077	0.0875	0.0875
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	g-protein coupled receptor	0.0043	0.0282	0.0282
Entamoeba histolytica	Xaa-Pro dipeptidase, putative	0.0077	0.0875	0.0875
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0043	0.0282	0.0282
Trypanosoma cruzi	metallo- peptidase, Clan MG, Family M24	0.0119	0.1623	0.082
Onchocerca volvulus	Methionine aminopeptidase 2 homolog	0.0594	1	1
Schistosoma mansoni	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus granulosus	methionyl aminopeptidase 2	0.0594	1	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0043	0.0282	0.0282
Echinococcus multilocularis	neuropeptides capa receptor	0.0043	0.0282	0.0282
Trichomonas vaginalis	Clan MG, familly M24, aminopeptidase P-like metallopeptidase	0.0594	1	1
Brugia malayi	G protein-coupled receptor F59B2.13	0.0043	0.0282	0.0282
Toxoplasma gondii	methionine aminopeptidase, type i, putative	0.0103	0.1325	0.0493
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0043	0.0282	0.0282
Echinococcus multilocularis	allatostatin A receptor	0.0043	0.0282	0.0282
Brugia malayi	larval opioid receptor	0.0043	0.0282	0.0282
Echinococcus granulosus	neuropeptide receptor A26	0.0043	0.0282	0.0282
Toxoplasma gondii	methionine aminopeptidase	0.0119	0.1623	0.082
Echinococcus granulosus	hypothetical protein	0.0043	0.0282	0.0282
Entamoeba histolytica	hypothetical protein, conserved	0.0077	0.0875	0.0875
Echinococcus multilocularis	methionyl aminopeptidase 1 (M24 family)	0.0119	0.1623	0.1623
Schistosoma mansoni	neuropeptide f receptor 76f	0.0043	0.0282	0.0282
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0043	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0043	0.0282	0.0282
Echinococcus multilocularis	FACT complex subunit SPT16	0.0077	0.0875	0.0875
Schistosoma mansoni	hypothetical protein	0.0043	0.0282	0.0282
Schistosoma mansoni	methionyl aminopeptidase 2 (M24 family)	0.0594	1	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0043	0.0282	0.0282

Activities

Activity type	Activity value	Assay description	Source	Reference
CL (ADMET)	= 5 uL/min.mg	Intrinsic clearance in human liver microsomes	ChEMBL.	17600707
CL (ADMET)	= 52 uL/min.mg	Intrinsic clearance in rat liver microsomes	ChEMBL.	17600707
IC50 (binding)	= 1866 nM	Inhibition of 11beta-HSD1 in human adipocytes	ChEMBL.	17600707
IC50 (binding)	= 1866 nM	Inhibition of 11beta-HSD1 in human adipocytes	ChEMBL.	17600707
Ki (binding)	= 22 nM	Binding affinity to human 11beta-HSD1 by SPA assay	ChEMBL.	17600707
Ki (binding)	= 22 nM	Binding affinity to human 11beta-HSD1 by SPA assay	ChEMBL.	17600707

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: CHEMBL396883

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 443655