TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 274.149 | Formula: C6H16N2O6P2
H donors: 5 H acceptors: 6 LogP: -6.98 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: OP(=O)(C(P(=O)(O)O)CNN1CCCC1)O
InChi: 1S/C6H16N2O6P2/c9-15(10,11)6(16(12,13)14)5-7-8-3-1-2-4-8/h6-7H,1-5H2,(H2,9,10,11)(H2,12,13,14)
InChiKey: JVRKRFPWDJALRO-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Trypanosoma cruzi	solanesyl-diphosphate synthase	Starlite/ChEMBL	References
Trypanosoma cruzi	farnesyl pyrophosphate synthase	Starlite/ChEMBL	References
Toxoplasma gondii	polyprenyl synthetase superfamily protein	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Polyprenyl synthetase family protein	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania infantum	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Schistosoma mansoni	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Cryptosporidium hominis	hypothetical protein	Get druggable targets OG5_126937	All targets in OG5_126937
Brugia malayi	Polyprenyl synthetase family protein	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma congolense	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium vivax	octaprenyl pyrophosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Echinococcus multilocularis	decaprenyl diphosphate synthase subunit 1	Get druggable targets OG5_126937	All targets in OG5_126937
Neospora caninum	hypothetical protein	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma brucei gambiense	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Giardia lamblia	Farnesyl diphosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania major	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Neospora caninum	hypothetical protein	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium knowlesi	octaprenyl pyrophosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma brucei	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma cruzi	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Babesia bovis	farnesyl pyrophosphate synthetase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Toxoplasma gondii	polyprenyl synthetase superfamily protein	Get druggable targets OG5_126937	All targets in OG5_126937
Leishmania donovani	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Toxoplasma gondii	polyprenyl synthetase superfamily protein	Get druggable targets OG5_127590	All targets in OG5_127590
Echinococcus granulosus	decaprenyl diphosphate synthase subunit 1	Get druggable targets OG5_126937	All targets in OG5_126937
Mycobacterium leprae	PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE)	Get druggable targets OG5_126937	All targets in OG5_126937
Cryptosporidium parvum	long chain fatty acyl diphosphate synthase	Get druggable targets OG5_126937	All targets in OG5_126937
Theileria parva	farnesyl pyrophosphate synthetase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Echinococcus multilocularis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Candida albicans	trans-hexaprenyltranstransferase	Get druggable targets OG5_126937	All targets in OG5_126937
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC1 (polyprenyl pyrophosphate synthetase)	Get druggable targets OG5_126937	All targets in OG5_126937
Candida albicans	similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase)	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium berghei	octaprenyl pyrophosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium knowlesi	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Plasmodium berghei	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania donovani	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania braziliensis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Schistosoma japonicum	ko:K00787 dimethylallyltranstransferase [EC2.5.1.1], putative	Get druggable targets OG5_127590	All targets in OG5_127590
Cryptosporidium hominis	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania mexicana	farnesyl pyrophosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania major	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Cryptosporidium parvum	putative farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	Get druggable targets OG5_127590	All targets in OG5_127590
Schistosoma mansoni	trans-prenyltransferase	Get druggable targets OG5_126937	All targets in OG5_126937
Echinococcus granulosus	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania infantum	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_126937	All targets in OG5_126937
Loa Loa (eye worm)	polyprenyl synthetase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania mexicana	farnesyl synthetase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Entamoeba histolytica	geranylgeranyl pyrophosphate synthetase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Loa Loa (eye worm)	polyprenyl synthetase	Get druggable targets OG5_126937	All targets in OG5_126937
Mycobacterium ulcerans	polyprenyl diphosphate synthetase, GrcC1	Get druggable targets OG5_126937	All targets in OG5_126937
Entamoeba histolytica	geranylgeranyl pyrophosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma brucei gambiense	farnesyl pyrophosphate synthetase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Plasmodium falciparum	octaprenyl pyrophosphate synthase	Get druggable targets OG5_126937	All targets in OG5_126937
Plasmodium yoelii	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Candida albicans	similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase)	Get druggable targets OG5_127590	All targets in OG5_127590
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Leishmania braziliensis	solanesyl-diphosphate synthase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Plasmodium yoelii	Polyprenyl synthetase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Schistosoma japonicum	ko:K00810 similar to prenyl diphosphate synthase, subunit 1 [EC:2.5.1.-], putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma brucei	farnesyl pyrophosphate synthase	Get druggable targets OG5_127590	All targets in OG5_127590
Theileria parva	prenyl transferase, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Schistosoma japonicum	Decaprenyl-diphosphate synthase subunit 1, putative	Get druggable targets OG5_126937	All targets in OG5_126937
Trypanosoma cruzi	solanesyl-diphosphate synthase	Get druggable targets OG5_126937	All targets in OG5_126937
Babesia bovis	polyprenyl synthetase superfamily protein	Get druggable targets OG5_126937	All targets in OG5_126937

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	solanesyl-diphosphate synthase	363 aa	362 aa	18.5 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.0279	1	1
Echinococcus granulosus	farnesyl pyrophosphate synthase	0.0279	1	1
Brugia malayi	geranylgeranyl pyrophosphate synthetase	0.0094	0.3186	0.3186
Leishmania major	solanesyl-diphosphate synthase, putative	0.0157	0.5529	0.5529
Schistosoma mansoni	farnesyl pyrophosphate synthase	0.0279	1	1
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC1 (polyprenyl pyrophosphate synthetase)	0.0064	0.2079	0.2079
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0157	0.5529	0.5529
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0632	0.0632
Echinococcus multilocularis	farnesyl pyrophosphate synthase	0.0279	1	1
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0447	0.0447
Echinococcus multilocularis	decaprenyl diphosphate synthase subunit 1	0.0157	0.5529	0.5529
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	0.0279	1	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0632	0.0632
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0632	0.1144
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0632	0.0632
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0632	0.0632
Mycobacterium tuberculosis	Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase)	0.0094	0.3186	0.3186
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0632	0.0632
Echinococcus granulosus	prenyl decaprenyl diphosphate synthase	0.0094	0.3186	0.3186
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0157	0.5529	0.5529
Echinococcus granulosus	geranylgeranyl pyrophosphate synthase	0.0094	0.3186	0.3186
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0157	0.5529	0.5529
Entamoeba histolytica	bifunctional short chain isoprenyl diphosphate synthase, putative	0.0094	0.3186	0.5764
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.037	0.037
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0447	0.0447
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.0447	0.0809
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0632	0.0632
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0632	0.0632
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase)	0.0094	0.3186	0.3186
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0406	0.0406
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.0279	1	1
Schistosoma mansoni	trans-prenyltransferase	0.0157	0.5529	0.5529
Giardia lamblia	Farnesyl diphosphate synthase	0.0279	1	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0632	0.1144
Trypanosoma cruzi	polyprenyl synthase, putative	0.0094	0.3186	0.3186
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0447	0.0447
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0279	1	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1465	0.1465
Leishmania major	farnesyl pyrophosphate synthase	0.0279	1	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0632	0.0632
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0632	0.0632
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0047	0.1465	0.1465
Echinococcus multilocularis	prenyl (decaprenyl) diphosphate synthase	0.0094	0.3186	0.3186
Mycobacterium ulcerans	polyprenyl synthetase IdsB	0.0094	0.3186	0.3186
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0632	0.0632
Trypanosoma brucei	farnesyl pyrophosphate synthase	0.0279	1	1
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0632	0.0632
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0632	0.0632
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0406	0.0406
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.1465	0.1465
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0447	0.0447
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0406	0.0406
Loa Loa (eye worm)	geranylgeranyl pyrophosphate synthetase	0.0094	0.3186	0.3186
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.037	0.037
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1465	0.1465
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	0.0279	1	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0447	0.0447
Mycobacterium ulcerans	polyprenyl diphosphate synthetase, GrcC1	0.0157	0.5529	0.5529
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.1465	0.1465
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0632	0.1144
Loa Loa (eye worm)	polyprenyl synthetase	0.0279	1	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0447	0.0447
Mycobacterium tuberculosis	Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate	0.0094	0.3186	0.3186
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0157	0.5529	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0632	0.1144
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0632	0.1144
Plasmodium vivax	octaprenyl pyrophosphate synthase, putative	0.0157	0.5529	0.5529
Schistosoma mansoni	ap endonuclease	0.0019	0.0447	0.0447
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0447	0.0447
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0632	0.0632
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0406	0.0406
Entamoeba histolytica	geranylgeranyl pyrophosphate synthetase, putative	0.0157	0.5529	1
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0447	0.0447
Onchocerca volvulus		0.0024	0.0632	1
Entamoeba histolytica	geranylgeranyl pyrophosphate synthase, putative	0.0157	0.5529	1
Brugia malayi	Polyprenyl synthetase family protein	0.0157	0.5529	0.5529
Plasmodium falciparum	octaprenyl pyrophosphate synthase	0.0157	0.5529	0.5529
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.1465	0.1465
Trypanosoma cruzi	polyprenyl synthase, putative	0.0094	0.3186	0.3186
Leishmania major	polyprenyl synthase, putative	0.0094	0.3186	0.3186
Chlamydia trachomatis	geranylgeranyl pyrophosphate synthase	0.0094	0.3186	1
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0406	0.0406
Echinococcus multilocularis	geranylgeranyl pyrophosphate synthase	0.0094	0.3186	0.3186
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0632	0.0632
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	0.0279	1	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0632	0.0632
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0632	0.0632
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	0.0279	1	1
Trypanosoma cruzi	solanesyl-diphosphate synthase	0.0157	0.5529	0.5529
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0447	0.0447
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0047	0.1465	0.1465
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	0.0279	1	1
Schistosoma mansoni	glutathione synthetase	0.0094	0.3186	0.3186
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0632	0.0632
Treponema pallidum	octaprenyl-diphosphate synthase	0.0094	0.3186	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0018	0.0406	0.0406
Schistosoma mansoni	ap endonuclease	0.0019	0.0447	0.0447
Trypanosoma cruzi	farnesyl pyrophosphate synthase	0.0279	1	1
Loa Loa (eye worm)	polyprenyl synthetase	0.0157	0.5529	0.5529
Schistosoma mansoni	geranylgeranyl pyrophosphate synthase	0.0094	0.3186	0.3186
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.1465	0.1465
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0447	0.0447
Toxoplasma gondii	exonuclease III APE	0.0019	0.0447	0.0447
Trypanosoma brucei	solanesyl-diphosphate synthase, putative	0.0157	0.5529	0.5529
Mycobacterium leprae	PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE)	0.0157	0.5529	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0632	0.0632
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.0279	1	1
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0406	0.0406
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.1465	0.1465
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0406	0.0406
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0447	0.0447
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.0279	1	1
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0094	0.3186	0.5391
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0447	0.0447
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0447	0.0447
Echinococcus granulosus	decaprenyl diphosphate synthase subunit 1	0.0157	0.5529	0.5529
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.037	0.037
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0406	0.0406
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0447	0.0447
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0632	0.0632
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.037	0.037

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.361 uM	Inhibition of Toxoplasma gondii FPPS	ChEMBL.	18096393
IC50 (binding)	= 0.361 uM	Inhibition of Toxoplasma gondii FPPS	ChEMBL.	18096393
IC50 (binding)	= 0.76 uM	Inhibition of Trypanosoma cruzi FPPS	ChEMBL.	18096393
IC50 (binding)	= 0.76 uM	Inhibition of Trypanosoma cruzi FPPS	ChEMBL.	18096393
IC50 (binding)	= 8.276 uM	Inhibition of Trypanosoma cruzi SPPS	ChEMBL.	18096393
IC50 (binding)	= 8.276 uM	Inhibition of Trypanosoma cruzi SPPS	ChEMBL.	18096393
IC50 (functional)	= 13.3 uM	Growth inhibition of Toxoplasma gondii tachyzoites in HFF cells	ChEMBL.	18096393
IC50 (functional)	= 13.3 uM	Growth inhibition of Toxoplasma gondii tachyzoites in HFF cells	ChEMBL.	18096393
IC50 (functional)	= 14 uM	Growth inhibition of Trypanosoma cruzi amastigotes in rat L6E9 cells	ChEMBL.	18096393
IC50 (functional)	= 14 uM	Growth inhibition of Trypanosoma cruzi amastigotes in rat L6E9 cells	ChEMBL.	18096393

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Toxoplasma gondii	ChEMBL23	18096393
Trypanosoma cruzi	ChEMBL23	18096393

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: CHEMBL258541

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 514348