TDR Targets

Basic information

Technical information

TDR Targets ID: 160172
Name: ethyl 4-[5-(2-aminopyrimidin-4-yl)-4-(4-fluor ophenyl)imidazol-1-yl]piperidine-1-carboxylat e
MW: 410.445 | Formula: C21H23FN6O2
H donors: 1 H acceptors: 4 LogP: 2.13 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)N1CCC(CC1)n1cnc(c1c1ccnc(n1)N)c1ccc(cc1)F
InChi: 1S/C21H23FN6O2/c1-2-30-21(29)27-11-8-16(9-12-27)28-13-25-18(14-3-5-15(22)6-4-14)19(28)17-7-10-24-20(23)26-17/h3-7,10,13,16H,2,8-9,11-12H2,1H3,(H2,23,24,26)
InChiKey: WNZMTWAJENZPDM-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

4-[5-(2-amino-4-pyrimidinyl)-4-(4-fluorophenyl)-1-imidazolyl]-1-piperidinecarboxylic acid ethyl ester
ethyl 4-[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]piperidine-1-carboxylate
4-[5-(2-aminopyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]piperidine-1-carboxylic acid ethyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	mitogen-activated protein kinase 14	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma congolense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Brugia malayi	P38 map kinase family protein 2	Get druggable targets OG5_128610	All targets in OG5_128610
Schistosoma japonicum	ko:K04441 p38 MAP kinase, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania braziliensis	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania mexicana	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania donovani	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania infantum	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei gambiense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	mitogen-activated protein kinase 14	360 aa	336 aa	33.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma cruzi	cytochrome P450, putative	0.0024	0.0415	0.0683
Loa Loa (eye worm)	steroid hormone receptor	0.0187	0.7401	0.7401
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0088	0.3155	0.1957
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0088	0.3155	0.3155
Schistosoma mansoni	coup transcription factor	0.0187	0.7401	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0187	0.7401	1
Loa Loa (eye worm)	carboxylesterase	0.0071	0.2416	0.2416
Mycobacterium tuberculosis	Possible cytochrome P450 135B1 Cyp135B1	0.0015	0.0013	0.5
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	hypothetical protein	0.0099	0.3609	0.3601
Mycobacterium tuberculosis	Probable cytochrome P450 132 Cyp132	0.0015	0.0013	0.5
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0088	0.3155	0.3155
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0088	0.3155	0.4262
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	ecdysteroid receptor	0.0187	0.7401	0.7398
Brugia malayi	Nuclear hormone receptor-like 1	0.0099	0.3609	0.3601
Echinococcus multilocularis	carboxylesterase 5A	0.0071	0.2416	0.3264
Echinococcus multilocularis		0.0015	0.0013	0.0017
Echinococcus granulosus	ecdysone induced protein 78C	0.0187	0.7401	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0187	0.7401	0.7401
Brugia malayi	nuclear receptor RXR	0.0088	0.3155	0.3146
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0247	1	1
Mycobacterium tuberculosis	Possible cytochrome P450 126 Cyp126	0.0015	0.0013	0.5
Onchocerca volvulus		0.0088	0.3155	0.1957
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0187	0.7401	1
Echinococcus granulosus	carboxylesterase 5A	0.0071	0.2416	0.3264
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0099	0.3609	0.3609
Echinococcus granulosus	acetylcholinesterase	0.0071	0.2416	0.3264
Mycobacterium tuberculosis	Probable cytochrome P450 138 Cyp138	0.0015	0.0013	0.5
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0187	0.7401	0.7398
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0108	0.4032	0.5447
Schistosoma mansoni	RAR-like nuclear receptor	0.0187	0.7401	1
Echinococcus granulosus	acetylcholinesterase	0.0071	0.2416	0.3264
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0088	0.3155	0.4262
Loa Loa (eye worm)	hypothetical protein	0.0079	0.2779	0.2779
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0088	0.3155	0.4262
Loa Loa (eye worm)	cytochrome P450 family protein	0.0024	0.0415	0.0415
Loa Loa (eye worm)	nuclear hormone receptor	0.0088	0.3155	0.3155
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0015	0.0013	0.5
Brugia malayi	nuclear hormone receptor	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	ecdysone receptor	0.0088	0.3155	0.3146
Brugia malayi	nuclear receptor NHR-67	0.0088	0.3155	0.3146
Mycobacterium leprae	putative cytochrome p450	0.0015	0.0013	0.5
Echinococcus granulosus	mitogen activated protein kinase 11	0.0152	0.5907	0.7981
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0088	0.3155	0.3146
Mycobacterium tuberculosis	Probable cytochrome P450 143 Cyp143	0.0015	0.0013	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 144 Cyp144	0.0015	0.0013	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0187	0.7401	0.7398
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0187	0.7401	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0187	0.7401	0.7401
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0187	0.7401	1
Brugia malayi	steroid hormone receptor	0.0187	0.7401	0.7398
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0187	0.7401	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0088	0.3155	0.4262
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0088	0.3155	0.4262
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0024	0.0415	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	Nuclear hormone receptor E75	0.0088	0.3155	0.3146
Brugia malayi	Nuclear hormone receptor E75	0.0088	0.3155	0.3146
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0088	0.3155	0.4262
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0187	0.7401	1
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.5907	1
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0187	0.7401	1
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.5907	0.7981
Loa Loa (eye worm)	DR-78	0.0088	0.3155	0.3155
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0187	0.7401	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0071	0.2416	0.2416
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.0082	0.2875	0.3885
Brugia malayi	hypothetical protein	0.0088	0.3155	0.3146
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0071	0.2416	0.3264
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0187	0.7401	1
Schistosoma mansoni	hypothetical protein	0.0066	0.2217	0.2996
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Brugia malayi	nuclear hormone receptor family member odr-7	0.0088	0.3155	0.3146
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0075	0.2601	0.3514
Echinococcus multilocularis	acetylcholinesterase	0.0071	0.2416	0.3264
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0088	0.3155	0.4262
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0187	0.7401	0.7401
Echinococcus multilocularis	jun protein	0.0082	0.2875	0.3885
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0099	0.3609	0.4876
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0099	0.3609	0.4876
Echinococcus multilocularis	FTZ F1 alpha	0.0187	0.7401	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0187	0.7401	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	nuclear receptor RXR	0.0099	0.3609	0.3601
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.5907	0.7981
Trypanosoma brucei	cytochrome P450, putative	0.0024	0.0415	0.0683
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.7401	1
Leishmania major	cytochrome p450-like protein	0.0024	0.0415	0.0683
Brugia malayi	Protein kinase domain containing protein	0.0015	0.0019	0.0006
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0187	0.7401	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0088	0.3155	0.4262
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0187	0.7401	1
Mycobacterium tuberculosis	Probable cytochrome P450 130 Cyp130	0.0015	0.0013	0.5
Loa Loa (eye worm)	CYP4Cod1	0.0024	0.0415	0.0415
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0187	0.7401	1
Schistosoma mansoni	hypothetical protein	0.0108	0.4032	0.5447
Brugia malayi	P38 map kinase family protein 2	0.0152	0.5907	0.5902
Mycobacterium tuberculosis	Probable cytochrome P450 137 Cyp137	0.0015	0.0013	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0187	0.7401	0.7398
Loa Loa (eye worm)	cytochrome P450 family protein	0.0024	0.0415	0.0415
Brugia malayi	orphan nuclear receptor NR2E1	0.0088	0.3155	0.3146
Brugia malayi	hypothetical protein	0.0064	0.2121	0.2111
Schistosoma mansoni	nuclear receptor nhr-48	0.0088	0.3155	0.4262
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0187	0.7401	0.7401
Echinococcus granulosus	jun protein	0.0082	0.2875	0.3885
Loa Loa (eye worm)	hypothetical protein	0.0099	0.3609	0.3609
Entamoeba histolytica	hypothetical protein	0.0108	0.4032	0.5
Brugia malayi	conserved hypotetical protein	0.0088	0.3155	0.3146
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0187	0.7401	1
Loa Loa (eye worm)	cytochrome P450 family protein	0.0056	0.1765	0.1765
Brugia malayi	tailless protein	0.0088	0.3155	0.3146
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0088	0.3155	0.4262
Brugia malayi	Cytochrome P450 family protein	0.0024	0.0415	0.0403
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.5907	0.7981
Mycobacterium tuberculosis	Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM)	0.0015	0.0013	0.5
Loa Loa (eye worm)	hypothetical protein	0.0099	0.3609	0.3609
Onchocerca volvulus		0.0088	0.3155	0.1957
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Schistosoma mansoni	hypothetical protein	0.0015	0.0013	0.0017
Brugia malayi	hypothetical protein	0.0099	0.3609	0.3601
Brugia malayi	nuclear hormone receptor	0.0088	0.3155	0.3146
Loa Loa (eye worm)	hypothetical protein	0.0071	0.2416	0.2416
Entamoeba histolytica	hypothetical protein	0.0108	0.4032	0.5
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0075	0.2601	0.3514
Brugia malayi	nuclear receptor NHR-88	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0187	0.7401	1
Mycobacterium tuberculosis	Cytochrome P450 121 Cyp121	0.0015	0.0013	0.5
Loa Loa (eye worm)	hypothetical protein	0.0099	0.3609	0.3609
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	0.0152	0.5907	0.5907
Echinococcus multilocularis	nuclear receptor nhr 48	0.0088	0.3155	0.4262
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0187	0.7401	1
Brugia malayi	hypothetical protein	0.0088	0.3155	0.3146
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0187	0.7401	1
Brugia malayi	Carboxylesterase family protein	0.0071	0.2416	0.2406
Brugia malayi	Cytochrome P450 family protein	0.0024	0.0415	0.0403
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0187	0.7401	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0099	0.3609	0.4876
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0108	0.4032	0.5447
Schistosoma mansoni	nuclear receptor	0.0088	0.3155	0.4262
Schistosoma mansoni	cytochrome P450	0.0015	0.0013	0.0017
Echinococcus granulosus	FTZ F1 alpha	0.0187	0.7401	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0099	0.3609	0.3609
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0187	0.7401	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0187	0.7401	0.7398
Mycobacterium tuberculosis	Probable cytochrome P450 136 Cyp136	0.0015	0.0013	0.5
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0099	0.3609	0.4876
Echinococcus granulosus	mitogen activated protein kinase 14	0.0152	0.5907	0.7981
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.5907	1
Brugia malayi	hypothetical protein	0.0108	0.4032	0.4024
Mycobacterium tuberculosis	Probable cytochrome P450 140 Cyp140	0.0015	0.0013	0.5
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0187	0.7401	0.7401
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Onchocerca volvulus	Bile acid receptor homolog	0.0187	0.7401	1
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0187	0.7401	1
Mycobacterium tuberculosis	Probable cytochrome P450 125 Cyp125	0.0015	0.0013	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0088	0.3155	0.4262
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Schistosoma mansoni	nuclear receptor	0.0088	0.3155	0.4262
Schistosoma mansoni	retinoic acid receptor RXR	0.0187	0.7401	1
Entamoeba histolytica	hypothetical protein	0.0108	0.4032	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0187	0.7401	0.7401
Echinococcus granulosus	thyroid hormone receptor alpha	0.0088	0.3155	0.4262
Brugia malayi	Cytochrome P450 family protein	0.0056	0.1765	0.1755
Echinococcus multilocularis	acetylcholinesterase	0.0071	0.2416	0.3264
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.7401	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0187	0.7401	1
Brugia malayi	bZIP transcription factor family protein	0.0082	0.2875	0.2866
Mycobacterium tuberculosis	Probable cytochrome P450 128 Cyp128	0.0015	0.0013	0.5
Echinococcus granulosus	cytochrome P450 2K1	0.0015	0.0013	0.0017
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0088	0.3155	0.3146
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0187	0.7401	0.7398
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0088	0.3155	0.4262
Mycobacterium tuberculosis	Possible cytochrome P450 135A1 Cyp135A1	0.0015	0.0013	0.5
Loa Loa (eye worm)	cytochrome P450	0.0015	0.0013	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0088	0.3155	0.1957
Trypanosoma cruzi	cytochrome P450, putative	0.0024	0.0415	0.0683
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	Nuclear hormone receptor-like 1	0.0099	0.3609	0.3601
Brugia malayi	Steroid receptor seven-up type 2	0.0187	0.7401	0.7398
Brugia malayi	nuclear receptor NHR-88	0.0088	0.3155	0.3146
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.5907	0.7981
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	0.0152	0.5907	1
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Brugia malayi	Carboxylesterase family protein	0.0071	0.2416	0.2406
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0187	0.7401	0.7398
Mycobacterium tuberculosis	Probable cytochrome P450 123 Cyp123	0.0015	0.0013	0.5
Schistosoma mansoni	nuclear hormone receptor	0.0187	0.7401	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.0187	0.7401	1
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0187	0.7401	0.7398
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0187	0.7401	0.7398
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0187	0.7401	1
Schistosoma mansoni	zinc finger protein	0.0088	0.3155	0.4262
Mycobacterium tuberculosis	Probable cytochrome P450 141 Cyp141	0.0015	0.0013	0.5
Schistosoma mansoni	transcription factor LCR-F1	0.0108	0.4032	0.5447
Echinococcus multilocularis	ecdysone induced protein 78C	0.0187	0.7401	1
Echinococcus granulosus	nuclear receptor nhr 48	0.0088	0.3155	0.4262
Mycobacterium leprae	Conserved hypothetical protein	0.0015	0.0013	0.5
Loa Loa (eye worm)	hypothetical protein	0.0187	0.7401	0.7401
Mycobacterium tuberculosis	Probable cytochrome P450 monooxygenase 142 Cyp142	0.0015	0.0013	0.5
Onchocerca volvulus		0.0187	0.7401	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.3155	0.3155
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0187	0.7401	0.7398
Loa Loa (eye worm)	hypothetical protein	0.0099	0.3609	0.3609
Loa Loa (eye worm)	acetylcholinesterase 1	0.0071	0.2416	0.2416
Schistosoma mansoni	jun-related protein	0.0066	0.2217	0.2996
Mycobacterium tuberculosis	Probable cytochrome P450 139 Cyp139	0.0015	0.0013	0.5
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0088	0.3155	0.4262
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0187	0.7401	0.7398
Schistosoma mansoni	nuclear hormone receptor	0.0088	0.3155	0.4262
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0187	0.7401	0.7398
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	0.0152	0.5907	1
Entamoeba histolytica	hypothetical protein	0.0108	0.4032	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 124 Cyp124	0.0015	0.0013	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0187	0.7401	0.7401
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.0082	0.2875	0.3885

Activities

Activity type	Activity value	Assay description	Source	Reference
Change (functional)	= -54 %	Inhibition of LPS-induced TNF synthesis in the mouse	ChEMBL.	11597418
Change (functional)	= -54 %	Inhibition of LPS-induced TNF synthesis in the mouse	ChEMBL.	11597418
IC50 (binding)	= 33 nM	Inhibition against Mitogen-activated protein kinase p38 alpha	ChEMBL.	11597418
IC50 (binding)	= 33 nM	Inhibition against Mitogen-activated protein kinase p38 alpha	ChEMBL.	11597418

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: CHEMBL95931
PubChem: 15407403

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 160172