TDR Targets

Basic information

Technical information

TDR Targets ID: 1084521
Name: [5-[4-amino-7-(4-chlorophenyl)-5-fluoro-1-(2- methylpropyl)benzimidazol-2-yl]furan-2-yl]pho sphonic acid
MW: 463.826 | Formula: C21H20ClFN3O4P
H donors: 3 H acceptors: 4 LogP: 3.51 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(cc1)c1cc(F)c(c2c1n(CC(C)C)c(n2)c1ccc(o1)P(=O)(O)O)N
InChi: 1S/C21H20ClFN3O4P/c1-11(2)10-26-20-14(12-3-5-13(22)6-4-12)9-15(23)18(24)19(20)25-21(26)16-7-8-17(30-16)31(27,28)29/h3-9,11H,10,24H2,1-2H3,(H2,27,28,29)
InChiKey: MZFUZMZNPCZZOB-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

[5-[4-amino-7-(4-chlorophenyl)-5-fluoro-1-isobutyl-benzimidazol-2-yl]-2-furyl]phosphonic acid
[5-[4-amino-7-(4-chlorophenyl)-5-fluoro-1-isobutyl-2-benzimidazolyl]-2-furyl]phosphonic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Fructose-1,6-bisphosphatase	Starlite/ChEMBL	References
Homo sapiens	fructose-1,6-bisphosphatase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Neospora caninum	Fructose-1 6-biphosphatase, related	Get druggable targets OG5_127400	All targets in OG5_127400
Schistosoma japonicum	ko:K03841 fructose-1,6-bisphosphatase I, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Brugia malayi	fructose-1,6-bisphosphatase	Get druggable targets OG5_127400	All targets in OG5_127400
Candida albicans	similar to S. cerevisiae FBP1 (YLR377C) Fructose-1,6-bisphosphatase	Get druggable targets OG5_127400	All targets in OG5_127400
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Trypanosoma brucei gambiense	fructose-1,6-bisphosphate, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Leishmania infantum	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Trypanosoma congolense	fructose-1,6-bisphosphate, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Leishmania braziliensis	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Trypanosoma brucei	fructose-1,6-bisphosphatase	Get druggable targets OG5_127400	All targets in OG5_127400
Toxoplasma gondii	fructose-bisphospatase II	Get druggable targets OG5_127400	All targets in OG5_127400
Leishmania mexicana	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Leishmania donovani	fructose-1,6-bisphosphatase, cytosolic, putative	Get druggable targets OG5_127400	All targets in OG5_127400
Echinococcus granulosus	fructose 16 bisphosphatase 1	Get druggable targets OG5_127400	All targets in OG5_127400
Schistosoma mansoni	fructose-16-bisphosphatase-related	Get druggable targets OG5_127400	All targets in OG5_127400
Echinococcus multilocularis	fructose 1,6 bisphosphatase 1	Get druggable targets OG5_127400	All targets in OG5_127400
Loa Loa (eye worm)	fructose-1,6-bisphosphatase	Get druggable targets OG5_127400	All targets in OG5_127400
Leishmania major		Get druggable targets OG5_127400	All targets in OG5_127400

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Neospora caninum	fructose-1,6-bisphosphatase, putative	Fructose-1,6-bisphosphatase	363 aa	298 aa	32.5 %
Onchocerca volvulus	CES-1 homolog	Fructose-1,6-bisphosphatase	363 aa	319 aa	60.5 %
Toxoplasma gondii	fructose-bisphospatase I	Fructose-1,6-bisphosphatase	363 aa	326 aa	31.3 %
Toxoplasma gondii	fructose-bisphospatase I	fructose-1,6-bisphosphatase 1	338 aa	326 aa	31.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0126	0.0092
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Echinococcus multilocularis	geminin	0.0164	0.3607	0.3585
Schistosoma mansoni	smad	0.0008	0.0088	0.0099
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0088	0.0094
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0066	0.0074
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0126	0.0143
Brugia malayi	nuclear hormone receptor family member odr-7	0.001	0.0126	0.0141
Echinococcus granulosus	flap endonuclease 1	0.0027	0.0523	0.049
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Loa Loa (eye worm)	Smad1	0.0008	0.0088	0.0094
Onchocerca volvulus		0.0047	0.0963	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	MH1 domain containing protein	0.0008	0.0088	0.0094
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0027	0.0523	0.0583
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0088	0.0099
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Schistosoma mansoni	nuclear hormone receptor	0.002	0.0369	0.0417
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.002	0.0369	0.0335
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Echinococcus multilocularis	fructose 1,6 bisphosphatase 1	0.0378	0.8407	0.8402
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0066	0.0031
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0088	0.0099
Echinococcus multilocularis	dnaJ subfamily B	0.0397	0.8835	0.8831
Schistosoma mansoni	cpg binding protein	0.0028	0.0537	0.0608
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	0.0378	0.8407	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0369	0.0429
Brugia malayi	photoreceptor-specific nuclear receptor	0.002	0.0369	0.0429
Schistosoma mansoni	hypothetical protein	0.0164	0.3607	0.4083
Brugia malayi	nuclear receptor NHR-88	0.002	0.0369	0.0429
Brugia malayi	Nuclear hormone receptor E75	0.001	0.0126	0.0141
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0027	0.0523	0.0583
Schistosoma mansoni	transcription factor LCR-F1	0.0038	0.0757	0.0857
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.002	0.0369	0.0335
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.001	0.0126	0.0143
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0104	0.0114
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0369	0.0429
Brugia malayi	MH1 domain containing protein	0.0008	0.0088	0.0094
Echinococcus multilocularis	thyroid hormone receptor alpha	0.002	0.0369	0.0335
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0152	0.0171
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0369	0.0429
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.002	0.0369	0.2897
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0369	0.0335
Leishmania major		0.0378	0.8407	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0369	0.0429
Brugia malayi	hypothetical protein	0.001	0.0126	0.0141
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0088	0.0053
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Loa Loa (eye worm)	nuclear hormone receptor	0.001	0.0126	0.0141
Trypanosoma cruzi	sedoheptulose-1,7-bisphosphatase, putative	0.0141	0.307	0.3625
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.002	0.0369	0.0429
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.002	0.0369	0.0429
Schistosoma mansoni	hypothetical protein	0.0164	0.3607	0.4083
Brugia malayi	steroid hormone receptor	0.002	0.0369	0.0429
Echinococcus multilocularis	survival motor neuron protein 1	0.023	0.507	0.5053
Echinococcus granulosus	thyroid hormone receptor alpha	0.001	0.0126	0.0092
Brugia malayi	nuclear receptor RXR	0.001	0.0126	0.0141
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0104	0.007
Echinococcus multilocularis	flap endonuclease 1	0.0027	0.0523	0.049
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0102	0.0111
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.002	0.0369	0.0335
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0369	0.0335
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Echinococcus granulosus	survival motor neuron protein 1	0.023	0.507	0.5053
Brugia malayi	Flap endonuclease-1	0.0027	0.0523	0.0613
Trichomonas vaginalis	helicase, putative	0.0006	0.0052	0.0356
Toxoplasma gondii	fructose-bisphospatase II	0.0378	0.8407	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0171
Trypanosoma cruzi	fructose-1,6-bisphosphatase, cytosolic, putative	0.0378	0.8407	1
Brugia malayi	tailless protein	0.001	0.0126	0.0141
Schistosoma mansoni	steroid hormone receptor ad4bp	0.002	0.0369	0.0417
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.002	0.0369	0.0429
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Schistosoma mansoni	xp-G/rad2 DNA repair endonuclease family	0.0006	0.0035	0.0039
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.002	0.0369	0.0429
Brugia malayi	nuclear receptor RXR	0.0011	0.0152	0.0171
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.001	0.0126	0.0092
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0369	0.0335
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Echinococcus granulosus	FTZ F1 alpha	0.002	0.0369	0.0335
Echinococcus multilocularis	neuropeptide s receptor	0.0449	1	1
Loa Loa (eye worm)	steroid hormone receptor	0.002	0.0369	0.0429
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.002	0.0369	0.0429
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.002	0.0369	0.0335
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.001	0.0126	0.0141
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0066	0.0031
Echinococcus granulosus	geminin	0.0164	0.3607	0.3585
Schistosoma mansoni	retinoic acid receptor RXR	0.002	0.0369	0.0417
Echinococcus granulosus	fructose 16 bisphosphatase 1	0.0378	0.8407	0.8402
Brugia malayi	MH2 domain containing protein	0.0116	0.2515	0.2985
Plasmodium falciparum	flap endonuclease 1	0.0027	0.0523	1
Schistosoma mansoni	Smad4	0.0008	0.0088	0.0099
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0171
Echinococcus granulosus	Nuclear hormone receptor HR96	0.001	0.0126	0.0092
Loa Loa (eye worm)	MH2 domain-containing protein	0.0116	0.2515	0.2985
Schistosoma mansoni	hypothetical protein	0.0397	0.8835	1
Schistosoma mansoni	hypothetical protein	0.0038	0.0757	0.0857
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0052	0.0356
Brugia malayi	hypothetical protein	0.023	0.507	0.6026
Echinococcus multilocularis	nuclear receptor nhr 48	0.001	0.0126	0.0092
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.002	0.0369	0.0335
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.001	0.0126	0.0092
Trypanosoma brucei	sedoheptulose-1,7-bisphosphatase	0.0141	0.307	0.3625
Schistosoma mansoni	fructose-16-bisphosphatase-related	0.0378	0.8407	0.9516
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0088	0.0094
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.001	0.0126	0.0143
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.002	0.0369	0.0417
Echinococcus granulosus	smad	0.0008	0.0088	0.0053
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Toxoplasma gondii	sedoheptulose-1,7-bisphosphatase	0.0141	0.307	0.3625
Schistosoma mansoni	coup transcription factor	0.002	0.0369	0.0417
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0537	0.0629
Entamoeba histolytica	Flap nuclease, putative	0.0027	0.0523	0.6762
Trypanosoma cruzi	sedoheptulose-1,7-bisphosphatase, putative	0.0141	0.307	0.3625
Brugia malayi	XPG I-region family protein	0.0006	0.0035	0.0031
Onchocerca volvulus	Bile acid receptor homolog	0.002	0.0369	0.2897
Brugia malayi	ecdysone receptor	0.001	0.0126	0.0141
Loa Loa (eye worm)	transcription factor SMAD2	0.0116	0.2515	0.2985
Entamoeba histolytica	hypothetical protein	0.0038	0.0757	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.002	0.0369	0.0335
Loa Loa (eye worm)	fructose-1,6-bisphosphatase	0.0378	0.8407	1
Brugia malayi	conserved hypotetical protein	0.001	0.0126	0.0141
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Brugia malayi	orphan nuclear receptor NR2E1	0.001	0.0126	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0088	0.0053
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.002	0.0369	0.0429
Brugia malayi	nuclear hormone receptor family member nhr-6	0.001	0.0126	0.0141
Onchocerca volvulus	Protein ultraspiracle homolog	0.002	0.0369	0.2897
Schistosoma mansoni	cpg binding protein	0.0029	0.0572	0.0648
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	hypothetical protein	0.0038	0.0757	0.0892
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Giardia lamblia	Flap structure-specific endonuclease	0.0027	0.0523	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0104	0.007
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.001	0.0126	0.0092
Loa Loa (eye worm)	nuclear receptor NHR-67	0.001	0.0126	0.0141
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0038	0.0757	0.0725
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.002	0.0369	0.0429
Schistosoma mansoni	RAR-like nuclear receptor	0.002	0.0369	0.0417
Toxoplasma gondii	fructose-bisphospatase I	0.0141	0.307	0.3625
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0369	0.0429
Loa Loa (eye worm)	hypothetical protein	0.023	0.507	0.6026
Loa Loa (eye worm)	flap endonuclease-1	0.0027	0.0523	0.0613
Echinococcus multilocularis	ecdysone induced protein 78C	0.002	0.0369	0.0335
Brugia malayi	nuclear receptor NHR-67	0.001	0.0126	0.0141
Plasmodium vivax	flap endonuclease 1, putative	0.0027	0.0523	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0369	0.0429
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0027	0.0523	0.0583
Echinococcus multilocularis	smad	0.0008	0.0088	0.0053
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0152	0.0171
Loa Loa (eye worm)	XPG I-region family protein	0.0006	0.0035	0.0031
Echinococcus granulosus	Smad4	0.0008	0.0088	0.0053
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0126	0.0143
Schistosoma mansoni	zinc finger protein	0.001	0.0126	0.0143
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.002	0.0369	0.0335
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.002	0.0369	0.0417
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0011	0.0152	0.0172
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0171
Echinococcus granulosus	nuclear receptor nhr 48	0.001	0.0126	0.0092
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0066	0.0031
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0038	0.0757	0.0725
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0369	0.0417
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0152	0.0172
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0059	0.1239	0.1403
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0027	0.0523	0.0583
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0088	0.0099
Echinococcus multilocularis	cpg binding protein	0.0029	0.0572	0.054
Echinococcus granulosus	ecdysone induced protein 78C	0.002	0.0369	0.0335
Brugia malayi	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	Steroid receptor seven-up type 2	0.002	0.0369	0.0429
Brugia malayi	nuclear hormone receptor	0.001	0.0126	0.0141
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.002	0.0369	0.0429
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.002	0.0369	0.0335
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0171
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.002	0.0369	0.0335
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.002	0.0369	0.0429
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0369	0.0335
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.002	0.0369	0.0417
Brugia malayi	hypothetical protein	0.0011	0.0152	0.0171
Echinococcus multilocularis	FTZ F1 alpha	0.002	0.0369	0.0335
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.002	0.0369	0.0417
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.001	0.0126	0.0141
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.001	0.0126	0.0092
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Entamoeba histolytica	hypothetical protein	0.0038	0.0757	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0066	0.0031
Brugia malayi	MH2 domain containing protein	0.0008	0.0088	0.0094
Schistosoma mansoni	xp-G/rad2 DNA repair endonuclease family member	0.0006	0.0035	0.0039
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.1097	0.1269
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0035	0.0031
Trypanosoma brucei	fructose-1,6-bisphosphatase	0.0378	0.8407	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.002	0.0369	0.0417
Schistosoma mansoni	cpg binding protein	0.0029	0.0572	0.0648
Onchocerca volvulus		0.0028	0.0537	0.4908
Echinococcus granulosus	dnaJ subfamily B	0.0397	0.8835	0.8831
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0035	0.0031
Brugia malayi	ecdysteroid receptor	0.002	0.0369	0.0429
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0537	0.0629
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0088	0.0053
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.001	0.0126	0.0092
Echinococcus multilocularis	neuropeptide receptor A26	0.0449	1	1
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0011	0.0152	0.0118
Trichomonas vaginalis	flap endonuclease-1, putative	0.0027	0.0523	1
Brugia malayi	MH2 domain containing protein	0.0008	0.0088	0.0094
Brugia malayi	nuclear receptor NHR-88	0.001	0.0126	0.0141
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	hypothetical protein	0.0011	0.0152	0.0171
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0369	0.0429
Schistosoma mansoni	nuclear receptor nhr-48	0.001	0.0126	0.0143
Schistosoma mansoni	flap endonuclease-1	0.0025	0.0464	0.0526
Echinococcus multilocularis	Smad4	0.0008	0.0088	0.0053
Entamoeba histolytica	hypothetical protein	0.0038	0.0757	1
Schistosoma mansoni	survival motor neuron protein	0.0047	0.0963	0.1089
Schistosoma mansoni	nuclear receptor	0.001	0.0126	0.0143
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.002	0.0369	0.0417
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Brugia malayi	Smad1	0.0008	0.0088	0.0094
Brugia malayi	Nuclear hormone receptor E75	0.001	0.0126	0.0141
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0126	0.0092
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0171
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.002	0.0369	0.0429
Schistosoma mansoni	exonuclease	0.0006	0.0035	0.0039
Entamoeba histolytica	hypothetical protein	0.0038	0.0757	1
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0047	0.0963	0.1136
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0052	0.0356
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0088	0.0053
Loa Loa (eye worm)	hypothetical protein	0.001	0.0126	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356
Onchocerca volvulus		0.002	0.0369	0.2897
Loa Loa (eye worm)	DR-78	0.001	0.0126	0.0141
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0011	0.0152	0.0171
Brugia malayi	nuclear hormone receptor	0.002	0.0369	0.0429
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0369	0.0417
Echinococcus granulosus	Nuclear hormone receptor HR96	0.001	0.0126	0.0092
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.002	0.0369	0.0429
Brugia malayi	fructose-1,6-bisphosphatase	0.0378	0.8407	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.002	0.0369	0.0429
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0088	0.0099
Echinococcus granulosus	cpg binding protein	0.0029	0.0572	0.054
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0011	0.0152	0.0118
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.002	0.0369	0.0429
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0052	0.0356
Loa Loa (eye worm)	hypothetical protein	0.002	0.0369	0.0429
Echinococcus granulosus	neuropeptide receptor A26	0.0449	1	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.002	0.0369	0.0429
Schistosoma mansoni	nuclear receptor	0.001	0.0126	0.0143
Schistosoma mansoni	hypothetical protein	0.0047	0.0963	0.1089
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0052	0.0356

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.09 uM	Inhibition of human liver FBPase 1	ChEMBL.	20055427
IC50 (binding)	= 2 uM	Inhibition of rat liver FBPase 1	ChEMBL.	20055427

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: CHEMBL585541

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1084521