TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 246.154 | Formula: C9H11O6P
H donors: 3 H acceptors: 5 LogP: -0.37 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)Cc1ccc(cc1)OCP(=O)(O)O
InChi: 1S/C9H11O6P/c10-9(11)5-7-1-3-8(4-2-7)15-6-16(12,13)14/h1-4H,5-6H2,(H,10,11)(H2,12,13,14)
InChiKey: MXICLCTVVFMUPA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	hypothetical protein	0.0037	0.0141	0.0141
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0125	0.0637	0.0992
Mycobacterium leprae	PROBABLE DNA POLYMERASE III (ALPHA CHAIN) DNAE1 (DNA NUCLEOTIDYLTRANSFERASE)	0.1126	0.6329	1
Trypanosoma cruzi	DNA topoisomerase III, putative	0.1151	0.6468	0.6465
Mycobacterium ulcerans	error-prone DNA polymerase	0.1121	0.6296	0.6293
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	0.1772	1	1
Leishmania major	DNA topoisomerase 1A	0.0651	0.3626	0.362
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Plasmodium falciparum	hexokinase	0.0123	0.0624	0.0601
Schistosoma mansoni	hypothetical protein	0.0555	0.3081	0.3081
Plasmodium falciparum	glutathione reductase	0.0049	0.0207	0.0183
Brugia malayi	beta-lactamase family protein	0.004	0.0158	0.0148
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0025
Schistosoma mansoni	trans-prenyltransferase	0.0704	0.3928	0.3928
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	0.1772	1	1
Echinococcus granulosus	DNA topoisomerase 3 beta 1	0.1151	0.6468	0.6468
Loa Loa (eye worm)	hexokinase	0.0123	0.0624	0.0615
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.1772	1	1
Brugia malayi	Thioredoxin reductase	0.0049	0.0207	0.0198
Echinococcus granulosus	decaprenyl diphosphate synthase subunit 1	0.0704	0.3928	0.3928
Toxoplasma gondii	ABC1 family protein	0.004	0.0158	0.0148
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0017	0.0025	0.0015
Mycobacterium tuberculosis	Probable lipase LipE	0.004	0.0158	0.0148
Mycobacterium tuberculosis	Probable DNA polymerase III (alpha chain) DnaE2 (DNA nucleotidyltransferase)	0.1126	0.6329	0.6325
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0283	0.1538	0.2247
Schistosoma mansoni	hypothetical protein	0.0555	0.3081	0.3081
Trypanosoma brucei	DNA topoisomerase ii	0.0283	0.1538	0.153
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0017	0.0025	0.0015
Treponema pallidum	DNA polymerase III subunit alpha	0.1121	0.6296	0.633
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Trypanosoma cruzi	hexokinase, putative	0.0123	0.0624	0.0615
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0017	0.0025	0.0015
Toxoplasma gondii	thioredoxin reductase	0.0049	0.0207	0.0198
Toxoplasma gondii	DNA topoisomerase 2, putative	0.0283	0.1538	0.153
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase)	0.0704	0.3928	0.3922
Mycobacterium ulcerans	hypothetical protein	0.004	0.0158	0.0148
Mycobacterium ulcerans	hypothetical protein	0.0032	0.0108	0.0099
Onchocerca volvulus		0.004	0.0158	0.0076
Echinococcus multilocularis	dnaJ subfamily B	0.0455	0.2512	0.2512
Brugia malayi	DNA topoisomerase III	0.0651	0.3626	0.362
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0149	0.014
Trypanosoma cruzi	solanesyl-diphosphate synthase	0.0704	0.3928	0.3922
Echinococcus granulosus	hexokinase type 2	0.0123	0.0624	0.0624
Echinococcus multilocularis	geminin	0.0555	0.3081	0.3081
Onchocerca volvulus		0.1151	0.6468	1
Trypanosoma brucei	hexokinase	0.0123	0.0624	0.0615
Trypanosoma brucei	hexokinase	0.0123	0.0624	0.0615
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.0089	0.0064
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0125	0.0637	0.0628
Trypanosoma brucei	PAB1-binding protein , putative	0.0028	0.0089	0.0079
Mycobacterium tuberculosis	Conserved protein	0.004	0.0158	0.0148
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.004	0.0158	0.0148
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0048	0.0198	0.0189
Mycobacterium tuberculosis	Probable reductase	0.0112	0.0566	0.0556
Brugia malayi	glutathione reductase	0.0049	0.0207	0.0198
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0704	0.3928	0.6224
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0037	0.0141	0.0141
Mycobacterium tuberculosis	Conserved protein	0.004	0.0158	0.0148
Leishmania major	mitochondrial DNA topoisomerase II	0.0283	0.1538	0.153
Leishmania major	hypothetical protein, conserved	0.004	0.0158	0.0148
Echinococcus granulosus	cytochrome P450 2K1	0.0014	0.001	0.001
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0025
Onchocerca volvulus		0.0123	0.0624	0.081
Schistosoma mansoni	cellular tumor antigen P53	0.0056	0.0244	0.0244
Mycobacterium ulcerans	polyprenyl synthetase IdsB	0.0704	0.3928	0.3922
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0017	0.0025	0.0015
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0015
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0198	0.0198
Schistosoma mansoni	cpg binding protein	0.0034	0.012	0.012
Treponema pallidum	DNA polymerase	0.0032	0.0108	0.0084
Plasmodium falciparum	DNA topoisomerase 3, putative	0.0651	0.3626	0.361
Brugia malayi	Hexokinase family protein	0.0123	0.0624	0.0615
Trypanosoma cruzi	farnesyl pyrophosphate synthase	0.1772	1	1
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0149	0.014
Mycobacterium ulcerans	beta-lactamase	0.004	0.0158	0.0148
Toxoplasma gondii	LsmAD domain-containing protein	0.0028	0.0089	0.0079
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0025
Trypanosoma brucei	DNA topoisomerase IA, putative	0.0651	0.3626	0.362
Onchocerca volvulus		0.0054	0.0232	0.0194
Entamoeba histolytica	hypothetical protein	0.0037	0.0141	0.0051
Echinococcus granulosus	prenyl decaprenyl diphosphate synthase	0.0704	0.3928	0.3928
Brugia malayi	Hexokinase family protein	0.0038	0.0143	0.0134
Echinococcus multilocularis	hexokinase	0.0123	0.0624	0.0624
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0158	0.0148
Echinococcus granulosus	hexokinase	0.0123	0.0624	0.0624
Mycobacterium tuberculosis	Probable hydrolase	0.004	0.0158	0.0148
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.004	0.0158	0.0148
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0704	0.3928	0.3922
Mycobacterium ulcerans	lipase LipD	0.004	0.0158	0.0148
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0015
Trypanosoma brucei	hypothetical protein, conserved	0.004	0.0158	0.0148
Brugia malayi	hypothetical protein	0.0037	0.0141	0.0131
Echinococcus granulosus	DNA topoisomerase 3 alpha	0.0651	0.3626	0.3626
Loa Loa (eye worm)	hexokinase type II	0.0123	0.0624	0.0615
Echinococcus multilocularis	hexokinase type 2	0.0123	0.0624	0.0624
Wolbachia endosymbiont of Brugia malayi	topoisomerase IA, TopA	0.0651	0.3626	0.5743
Trypanosoma brucei	DNA topoisomerase III, putative	0.0651	0.3626	0.362
Plasmodium vivax	DNA topoisomerase 3, putative	0.0651	0.3626	0.361
Mycobacterium ulcerans	hypothetical protein	0.0212	0.1132	0.1124
Trichomonas vaginalis	penicillin-binding protein, putative	0.004	0.0158	0.0133
Echinococcus multilocularis	tumor protein p63	0.038	0.2087	0.2087
Onchocerca volvulus	Hexokinase homolog	0.0077	0.0365	0.0402
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Giardia lamblia	Farnesyl diphosphate synthase	0.1772	1	1
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0283	0.1538	0.153
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0198	0.0198
Onchocerca volvulus		0.004	0.0158	0.0076
Loa Loa (eye worm)	TOPoisomerase family member	0.0283	0.1538	0.153
Trypanosoma brucei	farnesyl pyrophosphate synthase	0.1772	1	1
Leishmania major	hexokinase, putative	0.0123	0.0624	0.0615
Schistosoma mansoni	farnesyl pyrophosphate synthase	0.1772	1	1
Echinococcus multilocularis	rho GTPase activating protein 20	0.0651	0.3626	0.3626
Mycobacterium ulcerans	DNA topoisomerase I	0.0651	0.3626	0.362
Leishmania major	farnesyl pyrophosphate synthase	0.1772	1	1
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0403	0.0393
Mycobacterium leprae	PROBABLE URACIL-DNA GLYCOSYLASE UNG (UDG)	0.0074	0.035	0.0539
Entamoeba histolytica	DNA topoisomerase III, putative	0.0651	0.3626	0.5531
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Echinococcus granulosus	geranylgeranyl pyrophosphate synthase	0.176	0.9932	0.9932
Treponema pallidum	DNA topoisomerase I (topA)	0.0651	0.3626	0.3635
Schistosoma mansoni	DNA topoisomerase II	0.0283	0.1538	0.1538
Schistosoma mansoni	uracil-DNA glycosylase	0.0074	0.035	0.035
Brugia malayi	hypothetical protein	0.0263	0.1422	0.1413
Loa Loa (eye worm)	hexokinase	0.0123	0.0624	0.0615
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0198	0.0198
Plasmodium vivax	hypothetical protein, conserved	0.004	0.0158	0.0133
Mycobacterium leprae	Probable lipase LipE	0.004	0.0158	0.0234
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0704	0.3928	0.3922
Brugia malayi	Uracil-DNA glycosylase	0.0074	0.035	0.0341
Echinococcus granulosus	thioredoxin glutathione reductase	0.0049	0.0207	0.0207
Schistosoma mansoni	geranylgeranyl pyrophosphate synthase	0.176	0.9932	0.9932
Mycobacterium tuberculosis	Probable uracil-DNA glycosylase Ung (UDG)	0.0043	0.017	0.016
Schistosoma mansoni	hexokinase	0.0123	0.0624	0.0624
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0112	0.0566	0.0556
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0112	0.0566	0.0556
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.004	0.0158	0.0148
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0283	0.1538	0.153
Loa Loa (eye worm)	hypothetical protein	0.0263	0.1422	0.1413
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0367	0.2016	0.1996
Toxoplasma gondii	NADPH-glutathione reductase	0.0017	0.0025	0.0015
Echinococcus granulosus	hexokinase	0.0123	0.0624	0.0624
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0198	0.0198
Onchocerca volvulus		0.0123	0.0624	0.081
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.1772	1	1
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0651	0.3626	0.361
Mycobacterium tuberculosis	Probable dehydrogenase	0.0112	0.0566	0.0556
Brugia malayi	Polyprenyl synthetase family protein	0.0704	0.3928	0.3922
Schistosoma mansoni	cpg binding protein	0.0034	0.012	0.012
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Mycobacterium leprae	conserved hypothetical protein	0.0032	0.0108	0.0156
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0283	0.1538	0.1538
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0017	0.0025	0.0015
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0049	0.0207	0.0198
Schistosoma mansoni	cpg binding protein	0.0032	0.0109	0.0109
Schistosoma mansoni	glutathione synthetase	0.0704	0.3928	0.3928
Echinococcus granulosus	dnaJ subfamily B	0.0455	0.2512	0.2512
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0283	0.1538	0.1538
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0704	0.3928	0.3922
Entamoeba histolytica	hypothetical protein	0.0037	0.0141	0.0051
Brugia malayi	beta-lactamase	0.004	0.0158	0.0148
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0158	0.0133
Toxoplasma gondii	hexokinase	0.0123	0.0624	0.0615
Mycobacterium ulcerans	uracil-DNA glycosylase	0.0074	0.035	0.0341
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0017	0.0025	0.0015
Plasmodium vivax	DNA gyrase subunit B, putative	0.0283	0.1538	0.1517
Plasmodium vivax	ataxin-2 like protein, putative	0.0028	0.0089	0.0064
Mycobacterium ulcerans	DNA polymerase III subunit alpha	0.1121	0.6296	0.6293
Schistosoma mansoni	hypothetical protein	0.0455	0.2512	0.2512
Leishmania major	uracil-DNA-glycosylase, putative	0.0074	0.035	0.0341
Echinococcus granulosus	farnesyl pyrophosphate synthase	0.1772	1	1
Plasmodium vivax	hexokinase, putative	0.0123	0.0624	0.0601
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	0.1772	1	1
Brugia malayi	hypothetical protein	0.0018	0.0032	0.0022
Toxoplasma gondii	uracil-DNA glycosylase	0.0074	0.035	0.0341
Echinococcus multilocularis	beta LACTamase domain containing family member	0.004	0.0158	0.0158
Trypanosoma cruzi	DNA topoisomerase IA, putative	0.0651	0.3626	0.362
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0212	0.1132	0.1124
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0198	0.0198
Leishmania major	hexokinase, putative	0.0123	0.0624	0.0615
Leishmania major	DNA topoisomerase III, putative	0.1151	0.6468	0.6465
Mycobacterium tuberculosis	Probable DNA polymerase III (alpha chain) DnaE1 (DNA nucleotidyltransferase)	0.1126	0.6329	0.6325
Trypanosoma brucei	hexokinase, putative	0.0123	0.0624	0.0615
Mycobacterium tuberculosis	Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate	0.0704	0.3928	0.3922
Echinococcus multilocularis	hexokinase	0.0123	0.0624	0.0624
Echinococcus multilocularis	farnesyl pyrophosphate synthase	0.1772	1	1
Brugia malayi	CXXC zinc finger family protein	0.0032	0.0109	0.01
Trypanosoma cruzi	polyprenyl synthase, putative	0.176	0.9932	0.9932
Treponema pallidum	hexokinase (hxk)	0.0123	0.0624	0.0605
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.0089	0.0079
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0068	0.0313	0.0313
Entamoeba histolytica	geranylgeranyl pyrophosphate synthase, putative	0.0704	0.3928	0.6006
Wolbachia endosymbiont of Brugia malayi	DNA polymerase III alpha subunit	0.1121	0.6296	1
Plasmodium vivax	octaprenyl pyrophosphate synthase, putative	0.0704	0.3928	0.3913
Trypanosoma brucei	uracil-DNA glycosylase, putative	0.0074	0.035	0.0341
Echinococcus granulosus	hexokinase	0.0123	0.0624	0.0624
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0125	0.0637	0.0628
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Onchocerca volvulus		0.0123	0.0624	0.081
Schistosoma mansoni	G/t mismatch-specific thymine DNA glycosylase	0.0032	0.0108	0.0108
Echinococcus granulosus	survival motor neuron protein 1	0.0263	0.1422	0.1422
Schistosoma mansoni	cytochrome P450	0.0014	0.001	0.001
Trypanosoma cruzi	trypanothione reductase, putative	0.0017	0.0025	0.0015
Brugia malayi	hypothetical protein	0.0028	0.0089	0.0079
Plasmodium falciparum	octaprenyl pyrophosphate synthase	0.0704	0.3928	0.3913
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0704	0.3928	0.6224
Brugia malayi	beta-lactamase family protein	0.004	0.0158	0.0148
Giardia lamblia	DNA topoisomerase III	0.0651	0.3626	0.361
Loa Loa (eye worm)	thioredoxin reductase	0.0049	0.0207	0.0198
Echinococcus multilocularis	geranylgeranyl pyrophosphate synthase	0.176	0.9932	0.9932
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0283	0.1538	0.153
Loa Loa (eye worm)	polyprenyl synthetase	0.0704	0.3928	0.3922
Leishmania major	DNA topoisomerase III, putative	0.0651	0.3626	0.362
Onchocerca volvulus		0.0056	0.0244	0.0212
Trichomonas vaginalis	uracil DNA glycosylase, putative	0.0074	0.035	0.0326
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Echinococcus multilocularis	DNA topoisomerase 3 beta 1	0.1151	0.6468	0.6468
Mycobacterium ulcerans	DNA gyrase subunit B	0.0283	0.1538	0.153
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.0089	0.0079
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.1772	1	1
Loa Loa (eye worm)	geranylgeranyl pyrophosphate synthetase	0.176	0.9932	0.9932
Plasmodium vivax	glutathione reductase, putative	0.0049	0.0207	0.0183
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Loa Loa (eye worm)	polyprenyl synthetase	0.1772	1	1
Chlamydia trachomatis	geranylgeranyl pyrophosphate synthase	0.0704	0.3928	0.6224
Mycobacterium tuberculosis	Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase)	0.0704	0.3928	0.3922
Leishmania major	trypanothione reductase	0.0049	0.0207	0.0198
Entamoeba histolytica	geranylgeranyl pyrophosphate synthetase, putative	0.0704	0.3928	0.6006
Mycobacterium ulcerans	polyprenyl diphosphate synthetase, GrcC1	0.0704	0.3928	0.3922
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.1151	0.6468	0.6468
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0048	0.0198	0.0189
Treponema pallidum	DNA gyrase, subunit B (gyrB)	0.0283	0.1538	0.1527
Entamoeba histolytica	DNA topoisomerase II, putative	0.0283	0.1538	0.2248
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0283	0.1538	0.1517
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0017	0.0025	0.0015
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0017	0.0025	0.0015
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.0271	0.0262
Chlamydia trachomatis	DNA topoisomerase I	0.0651	0.3626	0.5743
Giardia lamblia	DNA topoisomerase III	0.1151	0.6468	0.6459
Mycobacterium ulcerans	glycosylase	0.0032	0.0108	0.0099
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Plasmodium falciparum	thioredoxin reductase	0.0049	0.0207	0.0183
Chlamydia trachomatis	DNA gyrase subunit B	0.0283	0.1538	0.2413
Mycobacterium leprae	conserved hypothetical protein	0.004	0.0158	0.0234
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0283	0.1538	0.153
Entamoeba histolytica	hypothetical protein	0.0037	0.0141	0.0051
Mycobacterium leprae	PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE)	0.0704	0.3928	0.6201
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0283	0.1538	0.153
Plasmodium falciparum	DNA gyrase subunit B	0.0283	0.1538	0.1517
Entamoeba histolytica	hypothetical protein	0.0037	0.0141	0.0051
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0283	0.1538	0.153
Schistosoma mansoni	survival motor neuron protein	0.0054	0.0232	0.0232
Echinococcus multilocularis	decaprenyl diphosphate synthase subunit 1	0.0704	0.3928	0.3928
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0158	0.0133
Trichomonas vaginalis	D-aminoacylase, putative	0.004	0.0158	0.0133
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0198	0.0198
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0651	0.3626	0.361
Mycobacterium tuberculosis	Probable lipase LipD	0.004	0.0158	0.0148
Echinococcus granulosus	beta LACTamase domain containing family member	0.004	0.0158	0.0158
Trypanosoma brucei	trypanothione reductase	0.0049	0.0207	0.0198
Trypanosoma cruzi	DNA topoisomerase III, putative	0.0651	0.3626	0.362
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.0651	0.3626	0.362
Echinococcus granulosus	tumor protein p63	0.038	0.2087	0.2087
Loa Loa (eye worm)	hypothetical protein	0.0056	0.0244	0.0234
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.1772	1	1
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.1772	1	1
Mycobacterium tuberculosis	Probable esterase LipL	0.004	0.0158	0.0148
Plasmodium vivax	uracil-DNA glycosylase, putative	0.0074	0.035	0.0326
Onchocerca volvulus		0.0077	0.0365	0.0402
Schistosoma mansoni	transcription factor LCR-F1	0.0037	0.0141	0.0141
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0158	0.0148
Echinococcus granulosus	uracil DNA glycosylase	0.0074	0.035	0.035
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.004	0.0158	0.0148
Mycobacterium tuberculosis	Probable uracil DNA glycosylase, UdgB	0.0032	0.0108	0.0099
Loa Loa (eye worm)	hexokinase	0.0077	0.0365	0.0355
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0017	0.0025	0.0015
Loa Loa (eye worm)	beta-lactamase	0.004	0.0158	0.0148
Trypanosoma brucei	DNA topoisomerase III, putative	0.1151	0.6468	0.6465
Echinococcus multilocularis		0.0014	0.001	0.001
Wolbachia endosymbiont of Brugia malayi	DNA gyrase, topoisomerase II, B subunit, GyrB	0.0283	0.1538	0.2413
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.004	0.0158	0.0148
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0049	0.0207	0.0207
Leishmania major	hypothetical protein, conserved	0.0028	0.0089	0.0079
Plasmodium vivax	thioredoxin reductase, putative	0.0049	0.0207	0.0183
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.0089	0.0064
Trichomonas vaginalis	penicillin-binding protein, putative	0.004	0.0158	0.0133
Brugia malayi	GRF zinc finger family protein	0.0283	0.1538	0.153
Schistosoma mansoni	hypothetical protein	0.0014	0.001	0.001
Giardia lamblia	DNA topoisomerase II	0.0283	0.1538	0.1517
Brugia malayi	hexokinase type II	0.0039	0.0149	0.014
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0017	0.0025	0.0015
Loa Loa (eye worm)	hypothetical protein	0.004	0.0158	0.0148
Entamoeba histolytica	DNA topoisomerase III, putative	0.1151	0.6468	1
Loa Loa (eye worm)	glutathione reductase	0.0049	0.0207	0.0198
Echinococcus granulosus	geminin	0.0555	0.3081	0.3081
Plasmodium falciparum	DNA topoisomerase 2	0.0283	0.1538	0.1517
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.0651	0.3626	0.3626
Mycobacterium ulcerans	esterase/lipase LipP	0.004	0.0158	0.0148
Brugia malayi	Hexokinase family protein	0.0077	0.0365	0.0355
Brugia malayi	hexokinase	0.0123	0.0624	0.0615
Wolbachia endosymbiont of Brugia malayi	uracil-DNA glycosylase	0.0032	0.0108	0.0133
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0089	0.0079
Entamoeba histolytica	hexokinase 1	0.0123	0.0624	0.0811
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	0.1772	1	1
Trypanosoma brucei	solanesyl-diphosphate synthase, putative	0.0704	0.3928	0.3922
Schistosoma mansoni	hypothetical protein	0.0054	0.0232	0.0232
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0158	0.0158
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0112	0.0566	0.0556
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0158	0.0158
Trypanosoma cruzi	hexokinase, putative	0.0123	0.0624	0.0615
Echinococcus multilocularis	hexokinase	0.0123	0.0624	0.0624
Leishmania major	polyprenyl synthase, putative	0.176	0.9932	0.9932
Treponema pallidum	octaprenyl-diphosphate synthase	0.176	0.9932	1
Plasmodium falciparum	uracil-DNA glycosylase	0.0074	0.035	0.0326
Leishmania major	solanesyl-diphosphate synthase, putative	0.0704	0.3928	0.3922
Chlamydia trachomatis	uracil DNA glycosylase	0.0074	0.035	0.0519
Trypanosoma cruzi	trypanothione reductase, putative	0.0049	0.0207	0.0198
Mycobacterium leprae	Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) (	0.0651	0.3626	0.5723
Brugia malayi	Probable DNA topoisomerase II	0.0283	0.1538	0.153
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0032	0.0109	0.01
Toxoplasma gondii	DNA topoisomerase family protein	0.0651	0.3626	0.362
Trypanosoma cruzi	uracil-DNA glycosylase	0.0074	0.035	0.0341
Echinococcus multilocularis	prenyl (decaprenyl) diphosphate synthase	0.0704	0.3928	0.3928
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0283	0.1538	0.2247
Echinococcus granulosus	cpg binding protein	0.0034	0.012	0.012
Mycobacterium tuberculosis	Probable oxidoreductase	0.0125	0.0637	0.0628
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0017	0.0025	0.0015
Trypanosoma cruzi	DNA topoisomerase IA, putative	0.0651	0.3626	0.362
Plasmodium vivax	DNA topoisomerase II, putative	0.0283	0.1538	0.1517
Mycobacterium tuberculosis	Conserved protein	0.004	0.0158	0.0148
Onchocerca volvulus		0.004	0.0158	0.0076
Entamoeba histolytica	uracil-DNA glycosylase, putative	0.0074	0.035	0.0381
Loa Loa (eye worm)	uracil-DNA glycosylase	0.0074	0.035	0.0341
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0283	0.1538	0.2247
Loa Loa (eye worm)	DNA topoisomerase III	0.0651	0.3626	0.362
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.004	0.0158	0.0148
Trichomonas vaginalis	esterase, putative	0.004	0.0158	0.0133
Brugia malayi	geranylgeranyl pyrophosphate synthetase	0.176	0.9932	0.9932
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0198	0.0198
Brugia malayi	DNA topoisomerase III beta-1	0.1151	0.6468	0.6465
Echinococcus multilocularis	cpg binding protein	0.0034	0.012	0.012
Trypanosoma cruzi	DNA topoisomerase III, putative	0.0651	0.3626	0.362
Echinococcus multilocularis	uracil DNA glycosylase	0.0074	0.035	0.035
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0112	0.0566	0.0556
Echinococcus multilocularis	survival motor neuron protein 1	0.0263	0.1422	0.1422
Entamoeba histolytica	bifunctional short chain isoprenyl diphosphate synthase, putative	0.0704	0.3928	0.6006
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0112	0.0566	0.088
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0017	0.0025	0.0015
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0259	0.1398	0.1389
Loa Loa (eye worm)	DNA topoisomerase III beta-1	0.1151	0.6468	0.6465
Chlamydia trachomatis	DNA polymerase III subunit alpha	0.1121	0.6296	1
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	0.1772	1	1
Loa Loa (eye worm)	hexokinase	0.0038	0.0143	0.0134
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0054	0.0232	0.0223
Trypanosoma cruzi	polyprenyl synthase, putative	0.176	0.9932	0.9932
Chlamydia trachomatis	DNA gyrase subunit B	0.0283	0.1538	0.2413
Entamoeba histolytica	hexokinase 2	0.0123	0.0624	0.0811
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0017	0.0025	0.0015
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0037	0.0141	0.0141

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	No inhibition 0 mM	Inhibition constant for human placental alkaline phosphatase at pH 9; No reduction in rate	ChEMBL.	15501071
Inhibition (binding)	= 0.13 mM	Inhibition constant protein phosphatase 2C in presence of [Mn2+] at 5 mM pH 7.5	ChEMBL.	15501071
Inhibition (binding)	= 0.19 mM	Inhibition constant for lambda protein phosphatase in presence of [Mn2+] at 5 mM pH 7.3	ChEMBL.	15501071
Inhibition (binding)	= 0.19 mM	Inhibition constant for lambda protein phosphatase in presence of [Mn2+] at 5 mM pH 7.3	ChEMBL.	15501071
Inhibition (binding)	= 5.1 mM	Inhibition constant for Escherichia coli alkaline phosphatase at pH 9	ChEMBL.	15501071
Inhibition (binding)	= 5.1 mM	Inhibition constant for Escherichia coli alkaline phosphatase at pH 9	ChEMBL.	15501071
Inhibition (binding)	= 12 mM	Inhibition constant for YOP protein tyrosine phosphatase at pH 6.6	ChEMBL.	15501071
Inhibition (binding)	= 12 mM	Inhibition constant for YOP protein tyrosine phosphatase at pH 6.6	ChEMBL.	15501071
Ki (binding)	= 1.1 mM	Compound was evaluated for the inhibition constant against Protein-tyrosine phosphatase (PTP1B )	ChEMBL.	10743947
Ki (binding)	= 2.6 mM	Compound was evaluated for the inhibition constant against dual specificity phosphatase VHR	ChEMBL.	10743947

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.

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External resources for this compound

ChEMBL: CHEMBL185003

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 322564