TDR Targets

Basic information

Technical information

TDR Targets ID: 185490
Name: methyl (2S)-2-[[8-(hydroxyamino)-8-oxooctanoy l]amino]-3-(4-methoxyphenyl)propanoate
MW: 380.435 | Formula: C19H28N2O6
H donors: 3 H acceptors: 4 LogP: 1.91 Rotable bonds: 15
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)[C@H](Cc1ccc(cc1)OC)NC(=O)CCCCCCC(=O)NO
InChi: 1S/C19H28N2O6/c1-26-15-11-9-14(10-12-15)13-16(19(24)27-2)20-17(22)7-5-3-4-6-8-18(23)21-25/h9-12,16,25H,3-8,13H2,1-2H3,(H,20,22)(H,21,23)/t16-/m0/s1
InChiKey: ZMQJPWQAQDTYQS-INIZCTEOSA-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

methyl (2S)-2-[[8-(hydroxyamino)-8-oxo-octanoyl]amino]-3-(4-methoxyphenyl)propanoate
(2S)-2-[[8-(hydroxyamino)-1,8-dioxooctyl]amino]-3-(4-methoxyphenyl)propanoic acid methyl ester
(2S)-2-[[8-(hydroxyamino)-8-keto-octanoyl]amino]-3-(4-methoxyphenyl)propionic acid methyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Histone deacetylase	Starlite/ChEMBL	References
Zea mays	Histone deacetylase HD2	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	histone deacetylase 3	Get druggable targets OG5_126742	All targets in OG5_126742
Neospora caninum	hypothetical protein	Get druggable targets OG5_126742	All targets in OG5_126742
Candida albicans	one of two distinct genes with strong similarity to S. cerevisiae RPD3 (YNL330C) SIN3 histone deacetylase complex component	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Theileria parva	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania mexicana	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Brugia malayi	Histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Cryptosporidium parvum	RPD3/HD1 histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania braziliensis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Babesia bovis	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Plasmodium knowlesi	histone deacetylase 1, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trypanosoma congolense	histone deacetylase-like 1 protein, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trypanosoma cruzi	histone deacetylase 1, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Candida albicans	one of two distinct genes with strong similarity to S. cerevisiae RPD3 (YNL330C) SIN3 histone deacetylase complex component	Get druggable targets OG5_126742	All targets in OG5_126742
Neospora caninum	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania infantum	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Toxoplasma gondii	histone deacetylase HDAC2	Get druggable targets OG5_126742	All targets in OG5_126742
Brugia malayi	histone deacetylase 1 (HD1)	Get druggable targets OG5_126742	All targets in OG5_126742
Schistosoma japonicum	ko:K01463 Hdac3 [EC:3.5.1.-], putative	Get druggable targets OG5_126742	All targets in OG5_126742
Schistosoma mansoni	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Echinococcus granulosus	histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Plasmodium berghei	histone deacetylase 1, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Cryptosporidium parvum	histone deacetylase HDA2/Rpd3p	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania donovani	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Candida albicans	one of two distinct genes with strong similarity to S. cerevisiae RPD3 (YNL330C) SIN3 histone deacetylase complex component	Get druggable targets OG5_126742	All targets in OG5_126742
Trypanosoma cruzi	histone deacetylase 1, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Loa Loa (eye worm)	histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Plasmodium falciparum	histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Plasmodium vivax	histone deacetylase 1, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania braziliensis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania mexicana	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Echinococcus multilocularis	histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Entamoeba histolytica	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania infantum	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trypanosoma brucei gambiense	histone deacetylase 1,histone deacetylase-like 1 protein, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Schistosoma japonicum	ko:K06067 histone deacetylase 1/2, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Echinococcus multilocularis	histone deacetylase 3	Get druggable targets OG5_126742	All targets in OG5_126742
Candida albicans	one of two distinct genes with strong similarity to S. cerevisiae RPD3 (YNL330C) SIN3 histone deacetylase complex component	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania major	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania major	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Schistosoma mansoni	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Plasmodium yoelii	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Cryptosporidium hominis	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Toxoplasma gondii	histone deacetylase HDAC3	Get druggable targets OG5_126742	All targets in OG5_126742
Cryptosporidium hominis	histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Giardia lamblia	Histone deacetylase	Get druggable targets OG5_126742	All targets in OG5_126742
Trypanosoma brucei	histone deacetylase 1	Get druggable targets OG5_126742	All targets in OG5_126742
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	Get druggable targets OG5_126742	All targets in OG5_126742
Brugia malayi	histone deacetylase 3 (HD3)	Get druggable targets OG5_126742	All targets in OG5_126742
Echinococcus granulosus	histone deacetylase 3	Get druggable targets OG5_126742	All targets in OG5_126742
Leishmania donovani	histone deacetylase, putative	Get druggable targets OG5_126742	All targets in OG5_126742

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Leishmania major	histone deacetylase, putative	Histone deacetylase	328 aa	338 aa	29.3 %
Schistosoma japonicum	ko:K01463 HDAC6,histone deacetylase [EC:3.5.1.-], putative	Histone deacetylase	328 aa	278 aa	39.6 %
Echinococcus granulosus	histone deacetylase 7	Histone deacetylase	328 aa	353 aa	41.1 %
Candida albicans	strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit	Histone deacetylase	328 aa	268 aa	40.7 %
Schistosoma japonicum	Histone deacetylase 4, putative	Histone deacetylase	328 aa	285 aa	50.9 %
Cryptosporidium hominis	hypothetical protein	Histone deacetylase	328 aa	278 aa	28.1 %
Leishmania mexicana	histone deacetylase, putative	Histone deacetylase	328 aa	267 aa	33.3 %
Trypanosoma congolense	histone deacetylase 4	Histone deacetylase	328 aa	285 aa	30.9 %
Cryptosporidium parvum	histone deactylase of possible bacterial origin with ankyrin repeats at the N-terminus	Histone deacetylase	328 aa	278 aa	28.4 %
Echinococcus granulosus	histone deacetylase 6	Histone deacetylase	328 aa	309 aa	38.5 %
Leishmania donovani	histone deacetylase, putative	Histone deacetylase	328 aa	338 aa	29.6 %
Onchocerca volvulus		Histone deacetylase	328 aa	267 aa	54.3 %
Echinococcus multilocularis	histone deacetylase 6	Histone deacetylase	328 aa	295 aa	36.3 %
Babesia bovis	histone deacetylase, putative	Histone deacetylase	328 aa	271 aa	28.4 %
Loa Loa (eye worm)	hypothetical protein	Histone deacetylase	328 aa	272 aa	29.8 %
Trypanosoma congolense	histone deacetylase 4	Histone deacetylase	328 aa	325 aa	29.8 %
Candida albicans	strong similarity to S. cerevisiae HDA1 (YNL021W) class II histone deacetylase HDA1 complex subunit	Histone deacetylase	328 aa	268 aa	40.7 %
Onchocerca volvulus	Dol-P-Man:Man(5)GlcNAc(2)-PP-Dol alpha-1,3-mannosyltransferase homolog	Histone deacetylase	328 aa	279 aa	29.0 %
Leishmania braziliensis	histone deacetylase, putative	Histone deacetylase	328 aa	284 aa	30.3 %
Echinococcus multilocularis	histone deacetylase 7	Histone deacetylase	328 aa	353 aa	40.8 %
Leishmania infantum	histone deacetylase, putative	Histone deacetylase	328 aa	338 aa	29.9 %
Schistosoma mansoni	histone deacetylase hda2	Histone deacetylase	328 aa	282 aa	38.3 %
Echinococcus granulosus	histone deacetylase 6	Histone deacetylase	328 aa	338 aa	34.6 %
Theileria parva	histone deacetylase, putative	Histone deacetylase	328 aa	278 aa	28.8 %
Echinococcus multilocularis	histone deacetylase 6	Histone deacetylase	328 aa	309 aa	38.2 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	protein kinase with ankyrin repeats, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Echinococcus granulosus	Phosphotidylinositol phosphatase PTPRQ	0.0475	0.706	0.706
Plasmodium vivax	tyrosine kinase-like protein, putative	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus granulosus	anosmin 1	0.0475	0.706	0.706
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Echinococcus granulosus	Phosphotidylinositol phosphatase PTPRQ	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Entamoeba histolytica	hypothetical protein, conserved	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Schistosoma mansoni	neuroglian	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0475	0.706	0.706
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	contactin neuroglian septate junction protein	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Twik (KCNK-like) family of potassium channels, alpha subunit 30.	0.0475	0.706	1
Echinococcus granulosus	Netrin receptor DCC	0.0475	0.706	0.706
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Echinococcus granulosus	Netrin receptor DCC	0.0475	0.706	0.706
Brugia malayi	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	Netrin receptor DCC	0.0475	0.706	0.706
Giardia lamblia	Kinase	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0475	0.706	0.706
Echinococcus multilocularis	Netrin receptor DCC	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus granulosus	anosmin 1	0.0475	0.706	0.706
Plasmodium falciparum	tyrosine kinase-like protein	0.014	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Entamoeba histolytica	receptor protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	protein tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.014	0	0.5
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0475	0.706	1
Toxoplasma gondii	protein kinase	0.014	0	0.5
Giardia lamblia	Protein 21.1	0.014	0	0.5
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0475	0.706	1
Plasmodium falciparum	protein kinase, putative	0.014	0	0.5
Echinococcus granulosus	nephrin	0.0475	0.706	0.706
Loa Loa (eye worm)	myotactin form A	0.0475	0.706	1
Trichomonas vaginalis	protein kinase atn1, putative	0.014	0	0.5
Brugia malayi	hypothetical protein	0.0475	0.706	1
Brugia malayi	SPRY domain containing protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trypanosoma cruzi	Fibronectin type III domain containing protein, putative	0.0475	0.706	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Giardia lamblia	Kinase, NEK	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0475	0.706	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0475	0.706	1
Schistosoma mansoni	cell adhesion molecule	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Echinococcus multilocularis	roundabout 2	0.0475	0.706	0.706
Brugia malayi	Lethal protein 805	0.0475	0.706	1
Echinococcus granulosus	roundabout 2	0.0475	0.706	0.706
Giardia lamblia	Kinase, NEK	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Echinococcus multilocularis	roundabout 2	0.0475	0.706	0.706
Brugia malayi	myotactin form B	0.0475	0.706	1
Plasmodium falciparum	protein kinase, putative	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0475	0.706	0.706
Echinococcus multilocularis	titin	0.0475	0.706	0.706
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Trypanosoma brucei	Fibronectin type III domain containing protein, putative	0.0475	0.706	1
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Echinococcus multilocularis	roundabout 2	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Brugia malayi	myotactin form A	0.0475	0.706	1
Schistosoma mansoni	hypothetical protein	0.0475	0.706	0.706
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Toxoplasma gondii	protein kinase domain-containing protein	0.014	0	0.5
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Echinococcus multilocularis	titin	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine- protein kinase 2, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Brugia malayi	Twik (KCNK-like) family of potassium channels, alpha subunit 32	0.0475	0.706	1
Echinococcus multilocularis	anosmin 1	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.014	0	0.5
Leishmania major	hypothetical protein, conserved	0.0475	0.706	1
Schistosoma mansoni	cell adhesion molecule	0.0475	0.706	0.706
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Loa Loa (eye worm)	UNCoordinated family member	0.0475	0.706	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0475	0.706	0.706
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Schistosoma mansoni	nephrin	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.014	0	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.014	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Loa Loa (eye worm)	lethal protein 805	0.0475	0.706	1
Echinococcus multilocularis	Fibronectin, type III	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Echinococcus granulosus	cell adhesion molecule	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Echinococcus granulosus	fibronectin type III domain-containing protein	0.0475	0.706	0.706
Echinococcus multilocularis	neuroglian	0.0475	0.706	0.706
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0615	1	1
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.0475	0.706	0.706
Echinococcus granulosus	Down syndrome cell adhesion molecule	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.014	0	0.5
Schistosoma mansoni	titin	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus granulosus	EG95	0.0475	0.706	0.706
Schistosoma mansoni	protein tyrosine phosphatase	0.0475	0.706	0.706
Echinococcus granulosus	titin	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Echinococcus granulosus	Fibronectin type III	0.0475	0.706	0.706
Echinococcus multilocularis	Down syndrome cell adhesion molecule	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Entamoeba histolytica	tyrosin kinase, putative	0.014	0	0.5
Echinococcus granulosus	Fibronectin type III domain containing protein	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Schistosoma mansoni	hemicentin	0.0475	0.706	0.706
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Schistosoma mansoni	factor for adipocyte differentiation	0.0475	0.706	0.706
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0475	0.706	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0475	0.706	0.706
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Schistosoma mansoni	titin	0.0475	0.706	0.706
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Schistosoma mansoni	nephrin	0.0475	0.706	0.706
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0475	0.706	0.706
Schistosoma mansoni	cell adhesion molecule	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Schistosoma mansoni	factor for adipocyte differentiation	0.0475	0.706	0.706
Loa Loa (eye worm)	CAMK protein kinase	0.0475	0.706	1
Schistosoma mansoni	factor for adipocyte differentiation	0.0475	0.706	0.706
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Entamoeba histolytica	tyrosin kinase, putative	0.014	0	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0475	0.706	0.706
Entamoeba histolytica	cysteine surface protein, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Echinococcus multilocularis	fibronectin type III domain-containing protein	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Schistosoma mansoni	hypothetical protein	0.0475	0.706	0.706
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Echinococcus granulosus	contactin	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.014	0	0.5
Echinococcus multilocularis	cell adhesion molecule	0.0475	0.706	0.706
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Echinococcus multilocularis	anosmin 1	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Echinococcus granulosus	roundabout 2	0.0475	0.706	0.706
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Echinococcus granulosus	titin	0.0475	0.706	0.706
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	leucine-rich repeat domain-containing protein	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0475	0.706	0.706
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0475	0.706	0.706
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Plasmodium vivax	protein kinase, putative	0.014	0	0.5
Plasmodium falciparum	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Onchocerca volvulus		0.0475	0.706	1
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Brugia malayi	Protein-tyrosine phosphatase	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	anosmin 1	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	Phosphotidylinositol phosphatase PTPRQ	0.0475	0.706	0.706
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Echinococcus granulosus	roundabout 2	0.0475	0.706	0.706
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Toxoplasma gondii	STE kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Echinococcus multilocularis	usherin	0.0475	0.706	0.706
Entamoeba histolytica	serine/threonine kinase, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	receptor protein kinase, putative	0.014	0	0.5
Schistosoma mansoni	tripartite motif protein trim9	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Entamoeba histolytica	ankyrin repeat protein	0.014	0	0.5
Schistosoma mansoni	hypothetical protein	0.0475	0.706	0.706
Schistosoma mansoni	cell adhesion molecule	0.0475	0.706	0.706
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Lethal protein 805	0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Brugia malayi	Fibronectin type III domain containing protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Echinococcus granulosus	anosmin 1	0.0475	0.706	0.706
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TK family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Echinococcus granulosus	neuroglian	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Echinococcus granulosus	usherin	0.0475	0.706	0.706
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Schistosoma mansoni	ephrin receptor	0.0615	1	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Echinococcus multilocularis	Fibronectin type III domain containing protein	0.0475	0.706	0.706
Echinococcus multilocularis	transfer RNA-Phe	0.0475	0.706	0.706
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Onchocerca volvulus		0.0475	0.706	1
Brugia malayi	protein unc-22	0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0475	0.706	1
Schistosoma mansoni	titin	0.0475	0.706	0.706
Schistosoma mansoni	myosin-binding protein-related	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Loa Loa (eye worm)	hypothetical protein	0.0475	0.706	1
Trichomonas vaginalis	AGC family protein kinase	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Entamoeba histolytica	hypothetical protein	0.014	0	0.5
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0475	0.706	1
Entamoeba histolytica	protein kinase, putative	0.014	0	0.5
Trypanosoma cruzi	Fibronectin type III domain containing protein, putative	0.0475	0.706	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0475	0.706	1
Schistosoma mansoni	cell adhesion molecule	0.0475	0.706	0.706
Loa Loa (eye worm)	projectin	0.0475	0.706	1
Trichomonas vaginalis	CAMK family protein kinase	0.014	0	0.5
Trichomonas vaginalis	STE family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein tyrosine kinase domain-containing protein	0.014	0	0.5
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Echinococcus granulosus	G1Y162 protein	0.0475	0.706	0.706
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0475	0.706	0.706
Onchocerca volvulus		0.0475	0.706	1
Trichomonas vaginalis	conserved hypothetical protein	0.014	0	0.5
Entamoeba histolytica	tyrosine kinase, putative	0.014	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.014	0	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.014	0	0.5
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0475	0.706	1
Entamoeba histolytica	hypothetical protein	0.014	0	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 250 nM	Inhibition of in vitro enzyme activity measured in a highly purified maize Histone deacetylase 2 preparation	ChEMBL.	12109913
IC50 (binding)	= 250 nM	Inhibition of in vitro enzyme activity measured in a highly purified maize Histone deacetylase 2 preparation	ChEMBL.	12109913
IC50 (binding)	= 800 nM	Inhibition of in vitro enzyme activity measured in partially purified rat liver Histone deacetylase preparation	ChEMBL.	12109913
IC50 (binding)	= 800 nM	Inhibition of in vitro enzyme activity measured in partially purified rat liver Histone deacetylase preparation	ChEMBL.	12109913
IC50 (functional)	= 11 uM	Tested in vivo for the inhibition of proliferation of friend leukemic cells	ChEMBL.	12109913

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: CHEMBL323695
PubChem: 10959862

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 185490