TDR Targets

Basic information

Technical information

TDR Targets ID: 984516
Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-naphthalen -1-ylurea
MW: 348.438 | Formula: C22H24N2O2
H donors: 2 H acceptors: 1 LogP: 5.38 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1NC(=O)Nc1cccc2c1cccc2)C(C)(C)C
InChi: 1S/C22H24N2O2/c1-22(2,3)16-12-13-20(26-4)19(14-16)24-21(25)23-18-11-7-9-15-8-5-6-10-17(15)18/h5-14H,1-4H3,(H2,23,24,25)
InChiKey: ICQWPUICUNPYEC-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

1-(5-tert-butyl-2-methoxy-phenyl)-3-(1-naphthyl)urea
1-(5-tert-butyl-2-methoxyphenyl)-3-(1-naphthyl)urea
1-(5-tert-butyl-2-methoxy-phenyl)-3-naphthalen-1-yl-urea

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
Trypanosoma cruzi	mitogen-activated protein 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
Echinococcus granulosus	mitogen activated protein kinase 14	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 brucei	mitogen-activated protein kinase 3, putative	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
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	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
Brugia malayi	P38 map kinase family protein 2	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
Echinococcus granulosus	mitogen activated protein kinase 11	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
Leishmania mexicana	mitogen-activated protein kinase 3, putative,map kinase 3, putative	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 major	mitogen-activated protein kinase 3, putative,map 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 brucei gambiense	mitogen-activated protein 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
Leishmania braziliensis	mitogen-activated protein kinase 3, putative,map kinase 3, putative	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
Entamoeba histolytica	hypothetical protein	0.0035	0.0119	0.0726
Echinococcus multilocularis	tyrosine kinase	0.023	0.1352	0.1352
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein (hisJ)	0.1152	0.7165	0.5
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.0858	0.6285
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0022	0.0035	0.0035
Echinococcus multilocularis	nmda type glutamate receptor	0.023	0.1352	0.1352
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0045	0.0165
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.0023	0.0023
Echinococcus multilocularis	Ribosomal protein S1, RNA binding domain	0.0449	0.2734	0.2734
Plasmodium vivax	FAD-linked sulfhydryl oxidase ERV1, putative	0.0033	0.0109	1
Echinococcus granulosus	dnaJ subfamily B	0.0841	0.5208	0.5208
Entamoeba histolytica	hypothetical protein	0.0035	0.0119	0.0726
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0045	0.0165
Schistosoma mansoni	cpg binding protein	0.0092	0.0479	0.0921
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Echinococcus granulosus	glutamate receptor 2	0.0523	0.3199	0.3199
Echinococcus granulosus	metabotropic glutamate receptor 5	0.023	0.1352	0.1352
Loa Loa (eye worm)	hypothetical protein	0.0307	0.1838	0.4012
Echinococcus multilocularis	geminin	0.0176	0.101	0.101
Brugia malayi	Metabotropic glutamate receptor precursor.	0.023	0.1352	0.2952
Loa Loa (eye worm)	metabotropic glutamate receptor 8	0.023	0.1352	0.2952
Echinococcus multilocularis	NMDA receptor	0.0449	0.2734	0.2734
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.002	0.0023	1
Schistosoma mansoni	glutamate receptor NMDA	0.0449	0.2734	0.5249
Loa Loa (eye worm)	metabotropic GABA-B receptor subtype 2	0.023	0.1352	0.2952
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0045	0.0097
Echinococcus granulosus	atrial natriuretic peptide receptor	0.023	0.1352	0.1352
Echinococcus multilocularis	metabotropic glutamate receptor 5	0.023	0.1352	0.1352
Giardia lamblia	DINP protein human, muc B family	0.002	0.0023	0.5
Schistosoma mansoni	hypothetical protein	0.0841	0.5208	1
Schistosoma mansoni	tyrosine kinase	0.023	0.1352	0.2596
Loa Loa (eye worm)	RGC/RGC protein kinase	0.023	0.1352	0.2952
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Echinococcus multilocularis	dnaJ subfamily B	0.0841	0.5208	0.5208
Brugia malayi	CXXC zinc finger family protein	0.0087	0.0448	0.0978
Echinococcus granulosus	muscleblind protein	0.0307	0.1838	0.1838
Echinococcus granulosus	glutamate NMDA receptor subunit	0.0449	0.2734	0.2734
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Echinococcus granulosus	dna polymerase kappa	0.002	0.0023	0.0023
Echinococcus granulosus	receptor type guanylyl cyclase	0.023	0.1352	0.1352
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0022	0.0035	0.0035
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0008	0.0017
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0045	0.0165
Brugia malayi	hypothetical protein	0.023	0.1352	0.2952
Trypanosoma brucei	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0033	0.0109	0.1032
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Onchocerca volvulus		0.023	0.1352	1
Echinococcus multilocularis	glutamate receptor 2	0.0523	0.3199	0.3199
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0045	0.0165
Echinococcus multilocularis	glutamate receptor 2	0.0742	0.458	0.458
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0023	0.0021
Schistosoma mansoni	ATP-binding cassette transporter	0.0449	0.2734	0.5249
Echinococcus multilocularis	muscleblind protein 1	0.0307	0.1838	0.1838
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0045	0.0052
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0027	0.0069	0.0069
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0045	0.0052
Chlamydia trachomatis	glutamine binding protein	0.1152	0.7165	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0219	0.0478
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.0858	0.0858
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0045	0.0052
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Leishmania major	extracellular receptor, putative	0.023	0.1352	1
Schistosoma mansoni	hypothetical protein	0.0176	0.101	0.1939
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.0858	0.0858
Schistosoma mansoni	hypothetical protein	0.0035	0.0119	0.0229
Schistosoma mansoni	glutamate receptor kainate	0.0449	0.2734	0.5249
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0045	0.0052
Trypanosoma cruzi	extracellular receptor, putative	0.023	0.1352	1
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0045	0.0052
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0022	0.0035	0.0068
Schistosoma mansoni	glutamate receptor AMPA	0.0449	0.2734	0.5249
Echinococcus granulosus	nmda type glutamate receptor	0.023	0.1352	0.1352
Brugia malayi	Glutamate receptor 2 precursor	0.0742	0.458	1
Echinococcus multilocularis	glutamate receptor, ionotrophic, AMPA 3	0.0972	0.6034	0.6034
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein	0.1152	0.7165	0.5
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0045	0.0052
Trypanosoma cruzi	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0033	0.0109	0.0648
Echinococcus multilocularis	muscleblind protein	0.0307	0.1838	0.1838
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Echinococcus granulosus	glutamate receptor ionotropic kainate 3	0.0449	0.2734	0.2734
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0022	0.0035	0.0035
Echinococcus granulosus	FAD linked sulfhydryl oxidase ALR	0.0033	0.0109	0.0109
Leishmania major	hypothetical protein, conserved	0.0033	0.0109	0.0648
Echinococcus granulosus	metabotropic glutamate receptor 2	0.023	0.1352	0.1352
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.068	0.4187	0.4187
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.0023	0.0029
Brugia malayi	Glutamate receptor 1 precursor	0.0742	0.458	1
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.0023	0.0029
Entamoeba histolytica	hypothetical protein	0.023	0.1352	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0045	0.5
Echinococcus multilocularis	metabotropic glutamate receptor 2	0.023	0.1352	0.1352
Loa Loa (eye worm)	RGC/RGC protein kinase	0.023	0.1352	0.2952
Echinococcus multilocularis	FAD linked sulfhydryl oxidase ALR	0.0033	0.0109	0.0109
Schistosoma mansoni	cpg binding protein	0.0087	0.0448	0.086
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0118	0.0257
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.0023	0.0023
Schistosoma mansoni	hypothetical protein	0.0449	0.2734	0.5249
Brugia malayi	Receptor family ligand binding region containing protein	0.023	0.1352	0.2952
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0033	0.0109	0.0648
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0023	0.0049
Brugia malayi	hypothetical protein	0.0035	0.0119	0.026
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.068	0.4187	0.4187
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0023	0.0021
Brugia malayi	Guanylyl cyclase protein 23	0.023	0.1352	0.2952
Schistosoma mansoni	glutamate receptor kainate	0.0449	0.2734	0.5249
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0119	0.0119
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.0023	0.0043
Schistosoma mansoni	glutamate receptor AMPA	0.0449	0.2734	0.5249
Echinococcus multilocularis	nmda type glutamate receptor	0.1601	1	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0045	0.0097
Entamoeba histolytica	hypothetical protein	0.0035	0.0119	0.0726
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0008	0.0017
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0119	0.0119
Loa Loa (eye worm)	glutamate receptor 1	0.0742	0.458	1
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Loa Loa (eye worm)	RGC/RGC protein kinase	0.023	0.1352	0.2952
Loa Loa (eye worm)	glutamate receptor 2	0.0449	0.2734	0.5968
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.0023	0.0043
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0185	0.1064	0.2043
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	0.0152	0.0858	0.6285
Schistosoma mansoni	glutamate receptor kainate	0.0449	0.2734	0.5249
Schistosoma mansoni	glutamate receptor NMDA	0.068	0.4187	0.804
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.068	0.4187	0.4187
Echinococcus multilocularis	glutamate receptor 4	0.0293	0.1746	0.1746
Schistosoma mansoni	DNA polymerase eta	0.002	0.0023	0.0043
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0023	0.0049
Schistosoma mansoni	protein kinase	0.023	0.1352	0.2596
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0045	0.5
Echinococcus granulosus	glutamate receptor ionotropic kainate	0.0449	0.2734	0.2734
Echinococcus granulosus	glutamate receptor subunit protein glur	0.0742	0.458	0.458
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0008	0.0017
Loa Loa (eye worm)	hypothetical protein	0.0293	0.1746	0.3811
Echinococcus granulosus	geminin	0.0176	0.101	0.101
Echinococcus granulosus	mitogen activated protein kinase 11	0.0152	0.0858	0.0858
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0051	0.0219	0.0478
Loa Loa (eye worm)	hypothetical protein	0.0293	0.1746	0.3811
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.0023	0.0049
Entamoeba histolytica	hypothetical protein	0.0035	0.0119	0.0726
Echinococcus granulosus	dna polymerase eta	0.002	0.0023	0.0023
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.002	0.0023	1
Onchocerca volvulus		0.0087	0.0448	0.3087
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.0858	0.6285
Onchocerca volvulus		0.023	0.1352	1
Echinococcus granulosus	mitogen activated protein kinase 14	0.0152	0.0858	0.0858
Schistosoma mansoni	hypothetical protein	0.0035	0.0118	0.0226
Brugia malayi	latrophilin 2 splice variant baaae	0.0035	0.0118	0.0257
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0027	0.0069	0.0069
Loa Loa (eye worm)	hypothetical protein	0.002	0.0023	0.0049
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0165	0.094	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0051	0.0219	0.0478
Echinococcus granulosus	glutamate receptor 4	0.0293	0.1746	0.1746
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0008	0.0017
Loa Loa (eye worm)	hepatopoietin HPO2	0.0033	0.0109	0.0238
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.0858	0.0858
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Mycobacterium ulcerans	glutamine-binding lipoprotein GlnH	0.1152	0.7165	1
Brugia malayi	metabotropic glutamate receptor type 2	0.023	0.1352	0.2952
Echinococcus multilocularis	glutamate receptor ionotropic kainate	0.0449	0.2734	0.2734
Mycobacterium tuberculosis	Probable glutamine-binding lipoprotein GlnH (GLNBP)	0.1152	0.7165	1
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.0858	0.0858
Loa Loa (eye worm)	hypothetical protein	0.0307	0.1838	0.4012
Echinococcus multilocularis	dna polymerase kappa	0.002	0.0023	0.0023
Schistosoma mansoni	metabotropic glutamate receptor	0.023	0.1352	0.2596
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0022	0.0035	0.0035
Loa Loa (eye worm)	hypothetical protein	0.023	0.1352	0.2952
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.068	0.4187	0.4187
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0045	0.0097
Loa Loa (eye worm)	receptor family ligand binding region containing protein	0.023	0.1352	0.2952
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0033	0.0109	0.0648
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0119	0.0229
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 3	0.1601	1	1
Loa Loa (eye worm)	hypothetical protein	0.0293	0.1746	0.3811
Trichomonas vaginalis	helicase, putative	0.002	0.0023	1
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.0045	0.0165
Brugia malayi	metabotropic GABA-B receptor subtype 2	0.023	0.1352	0.2952
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0008	0.0008
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0051	0.0219	0.0478
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0045	0.0097
Schistosoma mansoni	cpg binding protein	0.0092	0.0479	0.0921
Echinococcus granulosus	glutamate receptor ionotrophic AMPA 3	0.0972	0.6034	0.6034
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0045	0.006
Echinococcus granulosus	cpg binding protein	0.0092	0.0479	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0045	0.0097
Loa Loa (eye worm)	histone methyltransferase	0.0027	0.0069	0.015
Echinococcus multilocularis	atrial natriuretic peptide receptor	0.023	0.1352	0.1352
Loa Loa (eye worm)	glutamate receptor	0.023	0.1352	0.2952
Schistosoma mansoni	tyrosine kinase	0.023	0.1352	0.2596
Schistosoma mansoni	metabotropic glutamate receptor	0.023	0.1352	0.2596
Brugia malayi	P38 map kinase family protein 2	0.0152	0.0858	0.1874
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0087	0.0448	0.0978
Brugia malayi	Muscleblind-like protein	0.0307	0.1838	0.4012
Echinococcus granulosus	tyrosine kinase	0.023	0.1352	0.1352
Brugia malayi	F/Y-rich N-terminus family protein	0.0027	0.0067	0.0145
Echinococcus multilocularis	cpg binding protein	0.0092	0.0479	0.0479
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0045	0.0052
Echinococcus multilocularis	dna polymerase eta	0.002	0.0023	0.0023
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.068	0.4187	0.4187
Echinococcus multilocularis	glutamate receptor subunit protein glur	0.0742	0.458	0.458
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0023	1
Echinococcus granulosus	Ribosomal protein S1 RNA binding domain	0.0449	0.2734	0.2734
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0045	0.0097
Schistosoma mansoni	hypothetical protein	0.0176	0.101	0.1939
Echinococcus granulosus	glutamate receptor 2	0.0972	0.6034	0.6034
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	0.0152	0.0858	1
Brugia malayi	Augmenter of liver regeneration	0.0033	0.0109	0.0238
Brugia malayi	Receptor family ligand binding region containing protein	0.023	0.1352	0.2952
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0008	0.0017
Chlamydia trachomatis	arginine ABC transporter substrate-binding protein ArtJ	0.1152	0.7165	1
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.068	0.4187	0.4187
Echinococcus multilocularis	receptor type guanylyl cyclase	0.023	0.1352	0.1352
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0045	0.0165
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	0.0152	0.0858	0.1874
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0045	0.006
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0045	0.0052
Echinococcus multilocularis	glutamate receptor 2	0.0972	0.6034	0.6034
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0023	1
Onchocerca volvulus	Atrial natriuretic peptide receptor 3 homolog	0.023	0.1352	1
Echinococcus granulosus	glutamate receptor 1	0.0293	0.1746	0.1746
Plasmodium falciparum	FAD-linked sulfhydryl oxidase ERV1, putative	0.0033	0.0109	1
Echinococcus multilocularis	glutamate (NMDA) receptor subunit	0.0449	0.2734	0.2734

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 3900 nM	Binding affinity to p38alpha assessed as inhibition of ATF2 phosphorylation preincubated for 4 hrs	ChEMBL.	19356929
Tm (binding)	= 50.3 degrees C	Binding affinity to p38alpha assessed as melting temperature of enzyme-inhibitor complex by thermal denaturation assay	ChEMBL.	19356929

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: CHEMBL482969

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 984516