TDR Targets

Basic information

Technical information

TDR Targets ID: 184636
Name: (2R,3R,4S)-1-[2-(dibutylamino)-2-oxoethyl]-2- (4-methoxyphenyl)-4-pyridin-3-ylpyrrolidine-3 -carboxylic acid
MW: 467.6 | Formula: C27H37N3O4
H donors: 1 H acceptors: 4 LogP: 1.5 Rotable bonds: 13
Rule of 5 violations (Lipinski): 1
SMILES: CCCCN(C(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(cc1)OC)C(=O)O)c1cccnc1)CCCC
InChi: 1S/C27H37N3O4/c1-4-6-15-29(16-7-5-2)24(31)19-30-18-23(21-9-8-14-28-17-21)25(27(32)33)26(30)20-10-12-22(34-3)13-11-20/h8-14,17,23,25-26H,4-7,15-16,18-19H2,1-3H3,(H,32,33)/t23-,25-,26+/m1/s1
InChiKey: YVUPBKZFPLNWMD-ARMFNRFLSA-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

(2R,3R,4S)-1-[2-(dibutylamino)-2-oxo-ethyl]-2-(4-methoxyphenyl)-4-(3-pyridyl)pyrrolidine-3-carboxylic acid
(2R,3R,4S)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-4-(3-pyridyl)-3-pyrrolidinecarboxylic acid
(2R,3R,4S)-1-[2-(dibutylamino)-2-oxo-ethyl]-2-(4-methoxyphenyl)-4-pyridin-3-yl-pyrrolidine-3-carboxylic acid
(2R,3R,4S)-1-[2-(dibutylamino)-2-keto-ethyl]-2-(4-methoxyphenyl)-4-(3-pyridyl)pyrrolidine-3-carboxylic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Endothelin receptor ET-A	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	Endothelin receptor ET-A	426 aa	412 aa	20.1 %
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	Endothelin receptor ET-A	426 aa	412 aa	21.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.2384	1	1
Echinococcus multilocularis	SH2 domain containing protein 7	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Entamoeba histolytica	SH2 domain containing protein	0.1429	0.3312	0.3312
Toxoplasma gondii	protein kinase domain-containing protein	0.0956	0	0.5
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase ABL1	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase Src42A	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine kinase	0.2384	1	1
Schistosoma mansoni	SH2A	0.1429	0.3312	0.3312
Schistosoma mansoni	tensin	0.1429	0.3312	0.3312
Trichomonas vaginalis	CAMK family protein kinase	0.0956	0	0.5
Brugia malayi	SH2 domain containing protein	0.2384	1	1
Onchocerca volvulus		0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine kinase	0.2384	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Brugia malayi	Protein kinase domain containing protein	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Schistosoma mansoni	tyrosine-protein kinase zap-70	0.1429	0.3312	0.3312
Loa Loa (eye worm)	cytokine inducible SH2-containing protein 5	0.1429	0.3312	0.3312
Echinococcus multilocularis	NCK adaptor protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2384	1	1
Echinococcus multilocularis	tyrosine protein kinase Srms	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	signal transduction protein lnk-related	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	STAT protein	0.1429	0.3312	0.3312
Onchocerca volvulus		0.1429	0.3312	0.3312
Onchocerca volvulus		0.2384	1	1
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.1429	0.3312	0.3312
Echinococcus multilocularis	signal transduction protein lnk realted	0.1429	0.3312	0.3312
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.1429	0.3312	0.3312
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Echinococcus granulosus	expressed conserved protein	0.1429	0.3312	0.3312
Schistosoma mansoni	GTPase activating protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fps85D	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	Protein kinase domain containing protein	0.2384	1	1
Schistosoma mansoni	adapter molecule crk	0.1429	0.3312	0.3312
Trichomonas vaginalis	TK family protein kinase	0.0956	0	0.5
Brugia malayi	protein-tyrosine kinase	0.2384	1	1
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tensin	0.1429	0.3312	0.3312
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0956	0	0.5
Echinococcus multilocularis		0.1429	0.3312	0.3312
Echinococcus multilocularis	SH2 motif	0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein kinase Blk	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Onchocerca volvulus		0.1429	0.3312	0.3312
Echinococcus granulosus	SH2 motif	0.1429	0.3312	0.3312
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.0956	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0956	0	0.5
Onchocerca volvulus		0.1429	0.3312	0.3312
Brugia malayi	Tensin	0.1429	0.3312	0.3312
Brugia malayi	hypothetical protein	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine kinase	0.2384	1	1
Echinococcus multilocularis	SH2 motif	0.1429	0.3312	0.3312
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.1429	0.3312	0.3312
Echinococcus multilocularis	c src tyrosine kinase	0.2384	1	1
Schistosoma mansoni	nck2/grb4	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Schistosoma mansoni	tensin	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.2384	1	1
Loa Loa (eye worm)	SH2 domain-containing protein	0.1429	0.3312	0.3312
Onchocerca volvulus		0.1429	0.3312	0.3312
Schistosoma mansoni	growth factor receptor-bound protein	0.1429	0.3312	0.3312
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Leishmania major	hypothetical protein, conserved	0.0956	0	0.5
Brugia malayi	Variant SH3 domain containing protein	0.1429	0.3312	0.3312
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	TK/ABL protein kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0956	0	0.5
Onchocerca volvulus	Suppressor of cytokine signaling at 36E homolog	0.1429	0.3312	0.3312
Echinococcus granulosus	signal transduction protein lnk realted	0.1429	0.3312	0.3312
Echinococcus granulosus	c src tyrosine kinase	0.2384	1	1
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Onchocerca volvulus	Suppressor of cytokine signaling 7 homolog	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.2384	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Leishmania major	protein kinase, putative	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2384	1	1
Echinococcus multilocularis	tyrosine protein kinase Abl	0.2384	1	1
Schistosoma mansoni	tensin-related	0.1429	0.3312	0.3312
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.1429	0.3312	0.3312
Schistosoma mansoni	suppressor of cytokine signaling	0.1429	0.3312	0.3312
Leishmania major	protein kinase, putative	0.0956	0	0.5
Schistosoma mansoni	shc transforming protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2384	1	1
Echinococcus granulosus	tyrosine protein kinase shark	0.2384	1	1
Echinococcus multilocularis	growth factor receptor bound protein 2	0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.1429	0.3312	0.3312
Schistosoma mansoni	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	SH2 motif	0.1429	0.3312	0.3312
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Schistosoma mansoni	tensin-related	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	Tyrosine-protein kinase abl-1	0.2384	1	1
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0956	0	0.5
Trypanosoma brucei	AGC/RSK family serine/threonine kinase, putative	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Echinococcus multilocularis	SH2 domain containing adapter protein F	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	protein kinase atn1, putative	0.0956	0	0.5
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Onchocerca volvulus		0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0956	0	0.5
Giardia lamblia	Kinase, NEK	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.2384	1	1
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.2384	1	1
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0956	0	0.5
Plasmodium vivax	protein kinase, putative	0.0956	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0956	0	0.5
Onchocerca volvulus		0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.1429	0.3312	0.3312
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase shark	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein kinase Src64B	0.2384	1	1
Plasmodium falciparum	tyrosine kinase-like protein	0.0956	0	0.5
Trypanosoma brucei	STE/STE11 serine/threonine-protein kinase, putative	0.0956	0	0.5
Brugia malayi	Variant SH3 domain containing protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein kinase Src42A	0.2384	1	1
Plasmodium falciparum	protein kinase, putative	0.0956	0	0.5
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.2384	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Echinococcus multilocularis	suppressor of cytokine signaling 6	0.1429	0.3312	0.3312
Echinococcus multilocularis	SH2 motif	0.1429	0.3312	0.3312
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.1429	0.3312	0.3312
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein kinase Fps85D	0.2384	1	1
Echinococcus granulosus	SHC transforming protein 3	0.1429	0.3312	0.3312
Trypanosoma cruzi	protein kinase, putative	0.0956	0	0.5
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	SHC transforming protein 3	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2384	1	1
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.1429	0.3312	0.3312
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0956	0	0.5
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	hypothetical protein	0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.1429	0.3312	0.3312
Brugia malayi	RhoGAP domain containing protein	0.1429	0.3312	0.3312
Trypanosoma brucei	protein kinase, putative	0.0956	0	0.5
Trypanosoma brucei	Pseudokinase, putative	0.0956	0	0.5
Echinococcus granulosus	tensin	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.1429	0.3312	0.3312
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.1429	0.3312	0.3312
Echinococcus multilocularis	phosphatidylinositol 3 kinase regulatory subunit	0.1429	0.3312	0.3312
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.2384	1	1
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.2384	1	1
Echinococcus granulosus	tensin C1 domain containing phosphatase	0.1429	0.3312	0.3312
Brugia malayi	SRC-1	0.2384	1	1
Schistosoma mansoni	vav2	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Schistosoma mansoni	tensin	0.1429	0.3312	0.3312
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0956	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Onchocerca volvulus		0.2384	1	1
Schistosoma mansoni	growth factor receptor-bound protein	0.1429	0.3312	0.3312
Brugia malayi	SH2 domain containing protein	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Brugia malayi	tRNA modification GTPase TrmE family protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	AGC family protein kinase	0.0956	0	0.5
Echinococcus granulosus	SH2 domain containing adapter protein F	0.1429	0.3312	0.3312
Brugia malayi	cytokine inducible SH2-containing protein 5	0.1429	0.3312	0.3312
Loa Loa (eye worm)	SRC-1	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	hypothetical protein	0.1429	0.3312	0.3312
Toxoplasma gondii	STE kinase	0.0956	0	0.5
Echinococcus granulosus	suppressor of cytokine signaling 6	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tensin	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	TK protein kinase	0.2384	1	1
Loa Loa (eye worm)	hypothetical protein	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase Srms	0.2384	1	1
Toxoplasma gondii	protein kinase	0.0956	0	0.5
Echinococcus granulosus	suppressor of cytokine signaling 7	0.1429	0.3312	0.3312
Onchocerca volvulus		0.2384	1	1
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.2384	1	1
Trichomonas vaginalis	STE family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	TK/FER protein kinase	0.2384	1	1
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.2384	1	1
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.2384	1	1
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Plasmodium falciparum	protein kinase, putative	0.0956	0	0.5
Onchocerca volvulus		0.2384	1	1
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0956	0	0.5
Onchocerca volvulus		0.2384	1	1
Trypanosoma brucei	Flagellum attachment zone protein 20	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Entamoeba histolytica	protein kinase, putative	0.1429	0.3312	0.3312
Brugia malayi	Variant SH3 domain containing protein	0.1429	0.3312	0.3312
Brugia malayi	STAT protein, DNA binding domain containing protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Schistosoma mansoni	suppressor of cytokine signaling	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Giardia lamblia	Kinase, NEK	0.0956	0	0.5
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase Blk	0.2384	1	1
Echinococcus granulosus	phosphatidylinositol 3 kinase regulatory subunit	0.1429	0.3312	0.3312
Brugia malayi	Variant SH3 domain containing protein	0.1429	0.3312	0.3312
Loa Loa (eye worm)	SH2 domain-containing protein	0.1429	0.3312	0.3312
Echinococcus granulosus	tyrosine protein kinase Lyn	0.2384	1	1
Loa Loa (eye worm)	SH2 domain-containing protein	0.1429	0.3312	0.3312
Brugia malayi	Protein kinase domain containing protein	0.2384	1	1
Brugia malayi	SH2 domain containing protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	protein tyrosine kinase, putative	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	N chimaerin	0.1429	0.3312	0.3312
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.2384	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2384	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Echinococcus granulosus	NCK adaptor protein	0.1429	0.3312	0.3312
Schistosoma mansoni	tyrosine kinase	0.2384	1	1
Echinococcus granulosus	growth factor receptor bound protein 2	0.1429	0.3312	0.3312
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.1429	0.3312	0.3312
Echinococcus multilocularis	N chimaerin	0.1429	0.3312	0.3312
Loa Loa (eye worm)	hypothetical protein	0.1429	0.3312	0.3312
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Giardia lamblia	Kinase	0.0956	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0956	0	0.5
Giardia lamblia	Protein 21.1	0.0956	0	0.5
Brugia malayi	Sex muscle abnormal protein 5	0.1429	0.3312	0.3312
Trichomonas vaginalis	TKL family protein kinase	0.0956	0	0.5
Echinococcus granulosus	SH2 domain containing protein 7	0.1429	0.3312	0.3312
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0956	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.1429	0.3312	0.3312
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.0956	0	0.5
Brugia malayi	Protein kinase domain containing protein	0.2384	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.93 uM	Binding affinity towards endothelin A receptor in prolactin secreting rat pituitary cells using [125I]-ET-1 as radioligand.	ChEMBL.	9022798
IC50 (binding)	= 0.93 uM	Binding affinity towards endothelin A receptor in prolactin secreting rat pituitary cells using [125I]-ET-1 as radioligand.	ChEMBL.	9022798
IC50 (binding)	> 100 uM	Binding affinity towards endothelin B receptor in porcine cerebellar tissue using [125I]-ET-1 as radioligand.	ChEMBL.	9022798
IC50 (binding)	> 100 uM	Binding affinity towards endothelin B receptor in porcine cerebellar tissue using [125I]-ET-1 as radioligand.	ChEMBL.	9022798

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: CHEMBL113494
PubChem: 10576217

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 184636