TDR Targets

Basic information

Technical information

TDR Targets ID: 339805
Name: 2-[4-[2-[[[2-(4-bromothiophen-2-yl)-2-hydroxy ethyl]amino]methyl]phenoxy]butyl]isoindole-1, 3-dione
MW: 529.446 | Formula: C25H25BrN2O4S
H donors: 2 H acceptors: 3 LogP: 3.9 Rotable bonds: 11
Rule of 5 violations (Lipinski): 2
SMILES: Brc1csc(c1)C(CNCc1ccccc1OCCCCN1C(=O)c2c(C1=O)cccc2)O
InChi: 1S/C25H25BrN2O4S/c26-18-13-23(33-16-18)21(29)15-27-14-17-7-1-4-10-22(17)32-12-6-5-11-28-24(30)19-8-2-3-9-20(19)25(28)31/h1-4,7-10,13,16,21,27,29H,5-6,11-12,14-15H2
InChiKey: ZSCUXKJGNXUNNH-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

2-[4-[2-[[[2-(4-bromo-2-thienyl)-2-hydroxy-ethyl]amino]methyl]phenoxy]butyl]isoindoline-1,3-dione
2-[4-[2-[[[2-(4-bromo-2-thienyl)-2-hydroxyethyl]amino]methyl]phenoxy]butyl]isoindoline-1,3-dione
2-[4-[2-[[[2-(4-bromothiophen-2-yl)-2-hydroxy-ethyl]amino]methyl]phenoxy]butyl]isoindole-1,3-dione
2-[4-[2-[[[2-(4-bromo-2-thienyl)-2-hydroxy-ethyl]amino]methyl]phenoxy]butyl]isoindoline-1,3-quinone

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Staphylococcus aureus	Phenylalanyl-tRNA synthetase alpha chain	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania braziliensis	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Trypanosoma brucei gambiense	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Leishmania infantum	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Echinococcus granulosus	phenylalanyl tRNA synthetase alpha chain B	Get druggable targets OG5_127036	All targets in OG5_127036
Plasmodium berghei	phenylalanine--tRNA ligase alpha subunit, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Mycobacterium ulcerans	phenylalanyl-tRNA synthetase subunit alpha	Get druggable targets OG5_127036	All targets in OG5_127036
Giardia lamblia	Phenylalanyl-tRNA synthetase alpha chain	Get druggable targets OG5_127036	All targets in OG5_127036
Candida albicans	phenylalanyl-tRNA synthetase	Get druggable targets OG5_127036	All targets in OG5_127036
Schistosoma mansoni	phenylalanyl-tRNA synthetase subunit alpha	Get druggable targets OG5_127036	All targets in OG5_127036
Cryptosporidium hominis	phenylalanyl-trna synthetase-like protein	Get druggable targets OG5_127036	All targets in OG5_127036
Trichomonas vaginalis	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Toxoplasma gondii	phenylalanyl-tRNA synthetase alpha chain A, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Brugia malayi	phenylalanyl (f) trna synthetase protein 1	Get druggable targets OG5_127036	All targets in OG5_127036
Plasmodium falciparum	phenylalanine--tRNA ligase alpha subunit	Get druggable targets OG5_127036	All targets in OG5_127036
Trypanosoma brucei	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Cryptosporidium parvum	putative phenylalanyl-tRNA synthetase	Get druggable targets OG5_127036	All targets in OG5_127036
Trypanosoma cruzi	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Babesia bovis	phenylalanyl-tRNA synthetase family protein	Get druggable targets OG5_127036	All targets in OG5_127036
Plasmodium vivax	phenylalanine--tRNA ligase alpha subunit, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Plasmodium yoelii	phenylalanyl-tRNA synthetase, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Chlamydia trachomatis	phenylalanine--tRNA ligase subunit alpha	Get druggable targets OG5_127036	All targets in OG5_127036
Leishmania mexicana	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Leishmania donovani	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Neospora caninum	hypothetical protein	Get druggable targets OG5_127036	All targets in OG5_127036
Candida albicans	phenylalanyl-tRNA synthetase	Get druggable targets OG5_127036	All targets in OG5_127036
Mycobacterium leprae	Probable phenylalanyl-tRNA synthetase, alpha chain PheS	Get druggable targets OG5_127036	All targets in OG5_127036
Echinococcus multilocularis	phenylalanyl tRNA synthetase alpha chain B	Get druggable targets OG5_127036	All targets in OG5_127036
Entamoeba histolytica	phenylalanyl-tRNA synthetase alpha subunit, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Treponema pallidum	phenylalanyl-tRNA synthetase subunit alpha	Get druggable targets OG5_127036	All targets in OG5_127036
Wolbachia endosymbiont of Brugia malayi	phenylalanyl-tRNA synthetase subunit alpha	Get druggable targets OG5_127036	All targets in OG5_127036
Trypanosoma congolense	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Theileria parva	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127036	All targets in OG5_127036
Plasmodium knowlesi	phenylalanine--tRNA ligase alpha subunit, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Leishmania major	phenylalanyl-tRNA synthetase alpha chain, putative	Get druggable targets OG5_127036	All targets in OG5_127036
Mycobacterium tuberculosis	Probable phenylalanyl-tRNA synthetase, alpha chain PheS	Get druggable targets OG5_127036	All targets in OG5_127036
Schistosoma japonicum	ko:K01889 phenylalanyl-tRNA synthetase alpha chain [EC6.1.1.20A], putative	Get druggable targets OG5_127036	All targets in OG5_127036

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Babesia bovis	phenylalanine-tRNA ligase, putative	Phenylalanyl-tRNA synthetase alpha chain	352 aa	359 aa	24.8 %
Onchocerca volvulus	Presenilins-associated rhomboid-like protein, mitochondrial homolog	Phenylalanyl-tRNA synthetase alpha chain	352 aa	396 aa	25.0 %
Candida albicans	phenylalanine--tRNA ligase	Phenylalanyl-tRNA synthetase alpha chain	352 aa	314 aa	27.1 %
Echinococcus multilocularis	phenylalanyl tRNA synthetase	Phenylalanyl-tRNA synthetase alpha chain	352 aa	315 aa	28.3 %
Theileria parva	phenylalanyl-tRNA synthetase, putative	Phenylalanyl-tRNA synthetase alpha chain	352 aa	315 aa	24.4 %
Echinococcus granulosus	phenylalanyl tRNA synthetase	Phenylalanyl-tRNA synthetase alpha chain	352 aa	291 aa	29.6 %
Candida albicans	phenylalanine--tRNA ligase	Phenylalanyl-tRNA synthetase alpha chain	352 aa	314 aa	27.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.0003	0.0003
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0003	0.0012
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0003	0.0012
Entamoeba histolytica	acyl-coA synthetase, putative	0.0026	0.0173	0.1565
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.0003	0.0012
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0173	0.0371
Echinococcus granulosus	Protein patched homolog 1	0.0046	0.0405	0.0988
Onchocerca volvulus		0.0026	0.0173	0.35
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.005	0.0448	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.0003	0.0012
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.011	0.1125	1
Trichomonas vaginalis	phenylalanyl-tRNA synthetase alpha chain, putative	0.0088	0.0881	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.0003	0.0012
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0003	0.0003
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0003	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0088	0.0881	0.3115
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.0003	0.0029
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0448	0.3983
Mycobacterium tuberculosis	Probable phenylalanyl-tRNA synthetase, alpha chain PheS	0.0422	0.4666	1
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.0003	0.0008
Loa Loa (eye worm)	hypothetical protein	0.026	0.2829	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.0155	0.1634	0.1634
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.0003	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Brugia malayi	phenylalanyl-tRNA synthetase, mitochondrial precursor, putative	0.0026	0.0168	0.0593
Schistosoma mansoni	hypothetical protein	0.0053	0.0479	0.4259
Echinococcus granulosus	replication factor c subunit 1	0.0011	0.00000034704	0.00000084743
Schistosoma mansoni	phenylalanyl-tRNA synthetase mitochondrial	0.0026	0.0168	0.1492
Trypanosoma brucei	phenylalanyl-tRNA synthetase alpha chain, putative	0.0088	0.0881	1
Brugia malayi	nuclear receptor NHR-88	0.0011	0.0003	0.0012
Onchocerca volvulus		0.0012	0.0012	0.0247
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.0003	0.0029
Chlamydia trachomatis	phenylalanine--tRNA ligase subunit alpha	0.0422	0.4666	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.0003	0.0012
Treponema pallidum	phenylalanyl-tRNA synthetase subunit alpha	0.0088	0.0881	1
Echinococcus granulosus	phenylalanyl tRNA synthetase	0.0026	0.0168	0.041
Onchocerca volvulus		0.0011	0.0003	0.0066
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0173	0.0371
Entamoeba histolytica	phenylalanyl-tRNA synthetase alpha subunit, putative	0.0088	0.0881	0.7967
Plasmodium vivax	phenylalanine--tRNA ligase alpha subunit, putative	0.0088	0.0881	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.0003	0.0066
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.0003	0.0066
Plasmodium vivax	phenylalanine--tRNA ligase, putative	0.0026	0.0168	0.1905
Echinococcus multilocularis	phenylalanyl tRNA synthetase alpha chain B	0.0088	0.0881	0.0881
Echinococcus granulosus	muscleblind protein	0.0164	0.1742	0.4253
Plasmodium vivax	phenylalanine--tRNA ligase, putative	0.0026	0.0168	0.1905
Schistosoma mansoni	hypothetical protein	0.0045	0.0386	0.3426
Echinococcus granulosus	sterol regulatory element binding protein	0.0046	0.0405	0.0988
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0173	0.0371
Toxoplasma gondii	ATPase, AAA family protein	0.0011	0.00000034704	0.0000039381
Trichomonas vaginalis	conserved hypothetical protein	0.0046	0.0405	0.459
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0173	0.0371
Trypanosoma cruzi	phenylalanyl-tRNA synthetase alpha chain, putative	0.0088	0.0881	1
Leishmania major	phenylalanyl-tRNA synthetase alpha chain, putative	0.0088	0.0881	1
Schistosoma mansoni	survival motor neuron protein	0.0053	0.0479	0.4259
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0173	0.2931
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0173	0.0612
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.0003	0.0012
Giardia lamblia	Phenylalanyl-tRNA synthetase alpha chain	0.0088	0.0881	1
Trichomonas vaginalis	phenylalanyl-tRNA synthetase alpha chain, putative	0.0026	0.0168	0.1905
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0173	0.0371
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.0003	0.0008
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.0003	0.0003
Echinococcus multilocularis	muscleblind protein	0.0164	0.1742	0.1742
Entamoeba histolytica	Activator 1 140 kDa subunit, putative	0.0011	0.00000034704	0.0000031374
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.0003	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Onchocerca volvulus		0.0054	0.0494	1
Brugia malayi	CHE-14 protein	0.0046	0.0405	0.143
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0003	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Echinococcus multilocularis	replication factor c subunit 1	0.0011	0.00000034704	0.00000034704
Schistosoma mansoni	patched 1	0.0046	0.0405	0.3595
Echinococcus granulosus	tumor protein p63	0.0371	0.4095	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0098	0.0347
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0173	0.0612
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0173	0.019
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0003	0.0008
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.0003	0.0003
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0019	0.0098	0.0211
Schistosoma mansoni	phenylalanyl-tRNA synthetase subunit alpha	0.0088	0.0881	0.7832
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.0448	0.1094
Trichomonas vaginalis	replication factor C large subunit, putative	0.0011	0.00000034704	0.0000039381
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.0003	0.0008
Echinococcus granulosus	survival motor neuron protein 1	0.026	0.2829	0.6908
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0003	0.0008
Echinococcus multilocularis	phenylalanyl tRNA synthetase	0.0026	0.0168	0.0168
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.0003	0.0008
Brugia malayi	Niemann-Pick C1 protein precursor	0.0108	0.1106	0.391
Schistosoma mansoni	hypothetical protein	0.0045	0.0386	0.3426
Toxoplasma gondii	phenylalanyl-tRNA synthetase alpha chain A, putative	0.0088	0.0881	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.0003	0.0008
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.0003	0.0012
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0173	0.019
Echinococcus multilocularis	protein patched	0.0046	0.0405	0.0405
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0173	0.1565
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.0003	0.0012
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.0003	0.0029
Brugia malayi	Muscleblind-like protein	0.0164	0.1742	0.6157
Plasmodium falciparum	phenylalanine--tRNA ligase alpha subunit	0.0088	0.0881	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0003	0.0012
Echinococcus multilocularis	protein dispatched 1	0.0053	0.0479	0.0479
Echinococcus granulosus	Niemann Pick C1 protein	0.0155	0.1634	0.3989
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1106	0.391
Schistosoma mansoni	hypothetical protein	0.0045	0.0386	0.3426
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0011	0.00000034704	0.0000039381
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0003	0.0012
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.0003	0.0008
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0053	0.0479	0.1694
Brugia malayi	ecdysteroid receptor	0.0011	0.0003	0.0012
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0173	0.2931
Schistosoma mansoni	hypothetical protein	0.0045	0.0386	0.3426
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0173	0.1565
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0098	0.0347
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0003	0.0029
Schistosoma mansoni	coup transcription factor	0.0011	0.0003	0.0029
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0173	0.0371
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.0003	0.0012
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.0003	0.0012
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0003	0.0012
Brugia malayi	hypothetical protein	0.026	0.2829	1
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.0011	0.00000034704	0.0000039381
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.0003	0.0003
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0173	0.0612
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0494	0.1748
Echinococcus multilocularis	sterol regulatory element binding protein	0.0046	0.0405	0.0405
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.0003	0.0008
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0448	0.3983
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1742	0.6157
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.0003	0.0029
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0098	0.0026
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0405	0.143
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.0003	0.0029
Schistosoma mansoni	phenylalanyl-tRNA synthetase subunit alpha	0.0026	0.0168	0.1492
Echinococcus multilocularis	survival motor neuron protein 1	0.026	0.2829	0.2829
Echinococcus granulosus	Niemann Pick C1 protein	0.0108	0.1106	0.2701
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0019	0.0098	0.0211
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.0003	0.0029
Echinococcus multilocularis	muscleblind protein 1	0.0164	0.1742	0.1742
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.0003	0.0012
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0173	0.0612
Brugia malayi	phenylalanyl (f) trna synthetase protein 1	0.0088	0.0881	0.3115
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.0003	0.0012
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.0448	0.0448
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0003	0.0012
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.0448	0.1094
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0098	0.1115
Brugia malayi	nuclear hormone receptor	0.0011	0.0003	0.0012
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.0003	0.0003
Loa Loa (eye worm)	phenylalanyl-tRNA synthetase	0.0026	0.0168	0.0593
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0108	0.1106	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0003	0.0012
Echinococcus granulosus	phenylalanyl tRNA synthetase alpha chain B	0.0088	0.0881	0.2152
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0448	0.3983
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0173	0.0371
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0098	0.0347
Mycobacterium leprae	Probable phenylalanyl-tRNA synthetase, alpha chain PheS	0.0063	0.059	1
Echinococcus multilocularis	expressed conserved protein	0.0102	0.1032	0.1032
Echinococcus granulosus	expressed conserved protein	0.0102	0.1032	0.2519
Plasmodium falciparum	phenylalanine--tRNA ligase	0.0026	0.0168	0.1905
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0173	0.0612
Schistosoma mansoni	cellular tumor antigen P53	0.0054	0.0494	0.4395
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0173	0.0612
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.0003	0.0012
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.0003	0.0012
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1742	0.6157
Schistosoma mansoni	chromosome transmission fidelity factor	0.0011	0.00000034704	0.0000030844
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0003	0.0003
Wolbachia endosymbiont of Brugia malayi	phenylalanyl-tRNA synthetase subunit alpha	0.0422	0.4666	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.005	0.0448	0.1584
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.0003	0.0012
Echinococcus multilocularis	Niemann Pick C1 protein	0.0108	0.1106	0.1106
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0003	0.0029
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0173	0.0371
Plasmodium falciparum	phenylalanine--tRNA ligase	0.0026	0.0168	0.1905
Trichomonas vaginalis	phenylalanyl-tRNA synthetase alpha chain, putative	0.0026	0.0168	0.1905
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.0003	0.0012
Onchocerca volvulus		0.0053	0.0479	0.9691
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0098	0.0347
Echinococcus multilocularis	tumor protein p63	0.0371	0.4095	0.4095
Toxoplasma gondii	Ferredoxin-fold anticodon binding domain-containing protein	0.0026	0.0168	0.1905
Mycobacterium ulcerans	phenylalanyl-tRNA synthetase subunit alpha	0.0422	0.4666	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0523	0.1849
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.0003	0.0029
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.0003	0.0012
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0011	0.0003	0.0003
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.0448	0.0448
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0098	0.0347
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.0003	0.0066
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.0003	0.0029
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.0003	0.0003
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0046	0.0405	0.143
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0098	0.1115
Brugia malayi	steroid hormone receptor	0.0011	0.0003	0.0012

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 69 nM	Inhibitory concentration against Staphylococcus aureus Phenylalanyl-tRNA synthetase	ChEMBL.	15837314
IC50 (binding)	= 69 nM	Inhibitory concentration against Staphylococcus aureus Phenylalanyl-tRNA synthetase	ChEMBL.	15837314

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

PubChem: 23647958

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 339805