TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 990.288 | Formula: C54H88FN3O12
H donors: 4 H acceptors: 5 LogP: 6.54 Rotable bonds: 15
Rule of 5 violations (Lipinski): 2
SMILES: CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@H]([C@@H]([C@@H]2O)N(C)C)O)[C@@H](CCN2CC(C)CC(C2)C)C[C@H](/C(=N/OCc2ccc(cc2)F)/C=C/C(=C/C1CO[C@@H]1C[C@H](C)[C@H]([C@H]([C@H]1OC)OC)O)/C)C
InChi: 1S/C54H88FN3O12/c1-13-44-40(30-66-45-25-35(6)48(61)53(65-12)52(45)64-11)23-31(2)14-19-42(56-67-29-38-15-17-41(55)18-16-38)34(5)24-39(20-21-58-27-32(3)22-33(4)28-58)51(36(7)43(59)26-46(60)69-44)70-54-50(63)47(57(9)10)49(62)37(8)68-54/h14-19,23,32-37,39-40,43-45,47-54,59,61-63H,13,20-22,24-30H2,1-12H3/b19-14+,31-23+,56-42+/t32?,33?,34-,35+,36+,37-,39+,40?,43-,44-,45-,47+,48-,49-,50+,51-,52+,53-,54+/m1/s1
InChiKey: HYTUKWMLOOQHOD-UWORIJTNSA-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
Brugia malayi	Phosphoglycerate kinase	0.0057	0.0048	0.0048
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0053	0.0043	0.0227
Echinococcus multilocularis	short transient receptor potential channel 6	0.0062	0.0057	0.0491
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.01	0.0118	0.0118
Brugia malayi	Steroid receptor seven-up type 2	0.01	0.0118	0.0118
Echinococcus multilocularis	bromodomain containing 2	0.0128	0.0162	0.1379
Echinococcus granulosus	short transient receptor potential channel 6	0.0062	0.0057	0.0856
Brugia malayi	hypothetical protein	0.0053	0.0043	0.0043
Echinococcus granulosus	GPCR family 2	0.0062	0.0056	0.0839
Brugia malayi	nuclear receptor RXR	0.0053	0.0043	0.0043
Trichomonas vaginalis	conserved hypothetical protein	0.0071	0.0071	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0195	0.0268	0.0268
Brugia malayi	conserved hypotetical protein	0.0047	0.0034	0.0034
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0154	0.0203	0.0402
Brugia malayi	ecdysteroid receptor	0.01	0.0118	0.0118
Echinococcus multilocularis	6 phosphofructokinase	0.0326	0.0475	0.4054
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.01	0.0118	0.1752
Echinococcus granulosus	tumor protein p63	0.0319	0.0464	0.6906
Trichomonas vaginalis	bromodomain containing protein, putative	0.008	0.0085	0.1239
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.01	0.0118	0.1005
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.01	0.0118	0.0118
Brugia malayi	nuclear receptor NHR-67	0.0047	0.0034	0.0034
Onchocerca volvulus		0.0047	0.0034	0.0131
Trichomonas vaginalis	hypothetical protein	0.0456	0.0682	1
Loa Loa (eye worm)	phosphofructokinase	0.0326	0.0475	0.0475
Echinococcus granulosus	short transient receptor potential channel 6	0.0062	0.0057	0.0856
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Trichomonas vaginalis	phosphoglycerate kinase, putative	0.0154	0.0203	0.2981
Schistosoma mansoni	6-phosphofructokinase	0.0326	0.0475	0.2528
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0082	0.0082
Toxoplasma gondii	MAPEG family protein	0.007	0.007	0.102
Echinococcus granulosus	snurportin 1	0.0279	0.0401	0.5976
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0053	0.0043	0.0634
Mycobacterium ulcerans	6-phosphofructokinase	0.0326	0.0475	0.6547
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Brugia malayi	nuclear hormone receptor family member odr-7	0.0047	0.0034	0.0034
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Brugia malayi	Bromodomain containing protein	0.0128	0.0162	0.0162
Brugia malayi	nuclear receptor NHR-88	0.0047	0.0034	0.0034
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0128	0.0162	0.2368
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.01	0.0118	0.0118
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Leishmania major	dehydrogenase/oxidoreductase-like protein	0.0078	0.0082	0.0088
Schistosoma mansoni	transient receptor potential channel 4	0.0093	0.0107	0.0568
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0053	0.0043	0.0227
Leishmania major	phosphoglycerate kinase C, glycosomal	0.0154	0.0203	0.0402
Schistosoma mansoni	nuclear receptor	0.0047	0.0034	0.0179
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.01	0.0118	0.1752
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.01	0.0118	0.0118
Chlamydia trachomatis	enoyl-acyl-carrier protein reductase	0.0456	0.0682	1
Echinococcus granulosus	phosphoglycerate kinase 1	0.0154	0.0203	0.3028
Trichomonas vaginalis	bromodomain-containing protein, putative	0.008	0.0085	0.1239
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0047	0.0034	0.0034
Trypanosoma brucei	phosphoglycerate kinase	0.0057	0.0048	0.0124
Loa Loa (eye worm)	6-phosphofructokinase	0.0326	0.0475	0.0475
Loa Loa (eye worm)	hypothetical protein	0.0154	0.0203	0.0203
Echinococcus multilocularis	3 oxoacyl acyl carrier protein reductase	0.0078	0.0082	0.0702
Schistosoma mansoni	voltage-gated potassium channel	0.0034	0.0012	0.0064
Echinococcus multilocularis	short transient receptor potential channel 6	0.0062	0.0057	0.0491
Brugia malayi	steroid hormone receptor	0.01	0.0118	0.0118
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.01	0.0118	0.1752
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0031	0.0008	0.0008
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0195	0.0268	0.0268
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0047	0.0034	0.0034
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Onchocerca volvulus		0.0078	0.0082	0.5837
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0032	0.0032
Echinococcus granulosus	ecdysone induced protein 78C	0.01	0.0118	0.1752
Toxoplasma gondii	bromodomain-containing protein	0.0057	0.0049	0.0718
Echinococcus multilocularis	transient receptor potential ion channel A	0.0089	0.0099	0.0844
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.01	0.0118	0.0627
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0047	0.0034	0.0287
Schistosoma mansoni	steroid hormone receptor ad4bp	0.01	0.0118	0.0627
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0326	0.0475	0.1106
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0088	0.0098	0.0263
Brugia malayi	Nuclear hormone receptor-like 1	0.01	0.0118	0.0118
Toxoplasma gondii	phosphoglycerate kinase PGKI	0.0154	0.0203	0.2983
Schistosoma mansoni	hypothetical protein	0.0062	0.0056	0.03
Entamoeba histolytica	bromodomain-containing protein	0.0057	0.0049	0.0948
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0088	0.0098	0.1437
Echinococcus granulosus	6 phosphofructokinase	0.0326	0.0475	0.7069
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.01	0.0118	0.1005
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Echinococcus granulosus	3 oxoacyl acyl carrier protein reductase	0.0078	0.0082	0.1224
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0031	0.0008	0.0118
Echinococcus multilocularis	thyroid hormone receptor alpha	0.01	0.0118	0.1005
Brugia malayi	orphan nuclear receptor NR2E1	0.0047	0.0034	0.0034
Schistosoma mansoni	hypothetical protein	0.0029	0.0004	0.0023
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.01	0.0118	0.1005
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0062	0.0056	0.0056
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.01	0.0118	0.0118
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.01	0.0118	0.0118
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.01	0.0118	0.0627
Schistosoma mansoni	nuclear hormone receptor	0.01	0.0118	0.0627
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Brugia malayi	hypothetical protein	0.0049	0.0035	0.0035
Schistosoma mansoni	retinoic acid receptor RXR	0.01	0.0118	0.0627
Mycobacterium leprae	NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE)	0.0456	0.0682	1
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0088	0.0098	0.1437
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0062	0.0056	0.0481
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0043	0.0043
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0043	0.0043
Schistosoma mansoni	transient receptor potential channel	0.0062	0.0057	0.0306
Onchocerca volvulus	Bile acid receptor homolog	0.01	0.0118	1
Toxoplasma gondii	short chain dehydrogenase family protein, putative	0.0078	0.0082	0.1206
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.01	0.0118	0.0118
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.01	0.0118	1
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0047	0.0034	0.0131
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0062	0.0056	0.0056
Schistosoma mansoni	6-phosphofructokinase	0.0326	0.0475	0.2528
Toxoplasma gondii	3-ketoacyl-(acyl-carrier-protein) reductase	0.0078	0.0082	0.1206
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Trichomonas vaginalis	6-phosphofructokinase, putative	0.0088	0.0098	0.1435
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Schistosoma mansoni	transient receptor potential channel	0.0062	0.0057	0.0306
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0326	0.0475	1
Brugia malayi	tailless protein	0.0047	0.0034	0.0034
Loa Loa (eye worm)	hypothetical protein	0.6336	1	1
Trichomonas vaginalis	phosphoglycerate kinase, putative	0.0154	0.0203	0.2981
Entamoeba histolytica	bromodomain-containing protein	0.0057	0.0049	0.0948
Mycobacterium leprae	Probable phosphoglycerate kinase Pgk	0.0154	0.0203	0.202
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0029	0.0004	0.0037
Brugia malayi	Nuclear hormone receptor-like 1	0.0053	0.0043	0.0043
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0002	0.0002
Entamoeba histolytica	phosphoglycerate kinase, putative	0.0154	0.0203	0.423
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0047	0.0034	0.0179
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0031	0.0008	0.0008
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0088	0.0098	0.1437
Echinococcus multilocularis	FTZ F1 alpha	0.01	0.0118	0.1005
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.01	0.0118	0.1005
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0053	0.0043	0.0364
Brugia malayi	photoreceptor-specific nuclear receptor	0.01	0.0118	0.0118
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0088	0.0098	0.199
Entamoeba histolytica	phosphofructokinase, putative	0.0326	0.0475	1
Leishmania major	ATP-dependent phosphofructokinase	0.0326	0.0475	0.1106
Trypanosoma brucei	phosphoglycerate kinase	0.0154	0.0203	0.0521
Schistosoma mansoni	3-oxoacyl-[ACP] reductase	0.0078	0.0082	0.0438
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0076	0.0079	0.0422
Echinococcus multilocularis	snurportin 1	0.0279	0.0401	0.3427
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Leishmania major	malonyl-coa decarboxylase-like protein	0.249	0.3904	1
Brugia malayi	nuclear hormone receptor	0.01	0.0118	0.0118
Schistosoma mansoni	voltage-gated potassium channel	0.0034	0.0012	0.0064
Schistosoma mansoni	cellular tumor antigen P53	0.0047	0.0032	0.0173
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.249	0.3904	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0036	0.0015	0.0132
Loa Loa (eye worm)	hypothetical protein	0.0058	0.005	0.005
Plasmodium vivax	3-oxoacyl-[acyl-carrier-protein] reductase, putative	0.0078	0.0082	0.1206
Leishmania major	phosphoglycerate kinase B, cytosolic	0.0154	0.0203	0.0402
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.01	0.0118	0.0118
Brugia malayi	phosphofructokinase	0.0326	0.0475	0.0475
Onchocerca volvulus		0.0057	0.0049	0.1936
Loa Loa (eye worm)	bromodomain containing protein	0.0057	0.0049	0.0049
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.01	0.0118	0.0118
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0326	0.0475	0.1216
Brugia malayi	Latrophilin receptor protein 2	0.0062	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.01	0.0118	0.0627
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.0078	0.0082	0.0088
Loa Loa (eye worm)	DR-78	0.0047	0.0034	0.0034
Echinococcus granulosus	transient receptor potential ion channel A	0.0089	0.0099	0.1472
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0078	0.0082	0.0082
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.01	0.0118	0.0118
Schistosoma mansoni	transient receptor potential channel	0.0093	0.0107	0.0568
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0043	0.0043
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.01	0.0118	0.1752
Echinococcus granulosus	bromodomain containing 2	0.0128	0.0162	0.2405
Trypanosoma brucei	phosphoglycerate kinase, putative	0.0057	0.0048	0.0124
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.01	0.0118	0.0118
Brugia malayi	nuclear receptor NHR-88	0.01	0.0118	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Echinococcus granulosus	transient receptor potential gamma protein	0.0093	0.0107	0.1587
Schistosoma mansoni	dihydropteridine reductase	0.0078	0.0082	0.0438
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0088	0.0098	0.3175
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0029	0.0004	0.0065
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.01	0.0118	0.0118
Plasmodium vivax	enoyl-acyl carrier protein reductase	0.0456	0.0682	1
Loa Loa (eye worm)	retinol dehydrogenase 12	0.0078	0.0082	0.0082
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0162	0.0162
Onchocerca volvulus		0.0047	0.0034	0.0131
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0078	0.0082	0.0082
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0047	0.0034	0.0131
Schistosoma mansoni	nuclear hormone receptor	0.0047	0.0034	0.0179
Schistosoma mansoni	thyroid hormone receptor	0.01	0.0118	0.0627
Leishmania major	oxidoreductase-like protein	0.0078	0.0082	0.0088
Schistosoma mansoni	phosphoglycerate kinase	0.0154	0.0203	0.1083
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0015	0.0015
Onchocerca volvulus		0.0078	0.0082	0.5837
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Onchocerca volvulus	Protein ultraspiracle homolog	0.01	0.0118	1
Mycobacterium tuberculosis	NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase)	0.0456	0.0682	1
Brugia malayi	Nuclear hormone receptor E75	0.0047	0.0034	0.0034
Schistosoma mansoni	hypothetical protein	0.0062	0.0056	0.03
Brugia malayi	nuclear receptor RXR	0.0047	0.0034	0.0034
Plasmodium falciparum	3-oxoacyl-[acyl-carrier-protein] reductase	0.0078	0.0082	0.1206
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0062	0.0056	0.0839
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.01	0.0118	0.0118
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0128	0.0162	0.2368
Brugia malayi	Phosphoglycerate kinase	0.0154	0.0203	0.0203
Echinococcus multilocularis	geminin	0.045	0.0672	0.5734
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0047	0.0034	0.0287
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0326	0.0475	0.6547
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0043	0.0043
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0078	0.0082	0.0082
Toxoplasma gondii	enoyl-acyl carrier reductase ENR	0.0456	0.0682	1
Trypanosoma cruzi	beta-ketoacyl-ACP reductase	0.0078	0.0082	0.0088
Brugia malayi	Nuclear hormone receptor-like 1	0.0053	0.0043	0.0043
Schistosoma mansoni	RAR-like nuclear receptor	0.01	0.0118	0.0627
Brugia malayi	nuclear hormone receptor	0.0047	0.0034	0.0034
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0076	0.0079	0.0677
Entamoeba histolytica	phosphofructokinase, putative	0.0326	0.0475	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0195	0.0268	0.0268
Trichomonas vaginalis	phosphofructokinase, putative	0.0088	0.0098	0.1435
Toxoplasma gondii	6-phosphofructokinase	0.0088	0.0098	0.1437
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.01	0.0118	0.0118
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.01	0.0118	0.0118
Echinococcus granulosus	L aminoadipate semialdehyde	0.0076	0.0079	0.118
Plasmodium vivax	6-phosphofructokinase, putative	0.0088	0.0098	0.1437
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Onchocerca volvulus		0.0076	0.0079	0.5492
Chlamydia trachomatis	phosphoglycerate kinase	0.0154	0.0203	0.202
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Echinococcus multilocularis	nuclear receptor nhr 48	0.0047	0.0034	0.0287
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0411	0.061	0.061
Echinococcus multilocularis	phosphoglycerate kinase 1	0.0154	0.0203	0.1736
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Leishmania major	3-oxoacyl-ACP reductase, putative	0.0078	0.0082	0.0088
Brugia malayi	hypothetical protein	0.0029	0.0004	0.0004
Echinococcus granulosus	microsomal glutathione S transferase 3	0.007	0.007	0.1036
Brugia malayi	ecdysone receptor	0.0047	0.0034	0.0034
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Entamoeba histolytica	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0078	0.0082	0.1655
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0076	0.0079	0.0079
Echinococcus granulosus	nuclear receptor nhr 48	0.0047	0.0034	0.05
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.01	0.0118	0.1752
Schistosoma mansoni	coup transcription factor	0.01	0.0118	0.0627
Plasmodium falciparum	phosphoglycerate kinase	0.0154	0.0203	0.2983
Brugia malayi	6-phosphofructokinase	0.0326	0.0475	0.0475
Schistosoma mansoni	hypothetical protein	0.045	0.0672	0.3576
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Toxoplasma gondii	phosphofructokinase PFKII	0.0088	0.0098	0.1437
Schistosoma mansoni	thyroid hormone receptor	0.01	0.0118	0.0627
Echinococcus multilocularis	microsomal glutathione S transferase 3	0.007	0.007	0.0594
Treponema pallidum	phosphoglycerate kinase	0.0154	0.0203	0.2797
Schistosoma mansoni	hypothetical protein	0.0133	0.017	0.0905
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.01	0.0118	0.0118
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0765	0.1171	1
Mycobacterium ulcerans	enoyl-(acyl carrier protein) reductase	0.0456	0.0682	1
Schistosoma mansoni	hypothetical protein	0.0279	0.0401	0.2137
Entamoeba histolytica	bromodomain-containing protein	0.0057	0.0049	0.0948
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0008	0.0008
Trypanosoma brucei	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.249	0.3904	1
Loa Loa (eye worm)	oxidoreductase	0.0078	0.0082	0.0082
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.01	0.0118	0.0118
Brugia malayi	follicle stimulating hormone receptor	0.0411	0.061	0.061
Plasmodium vivax	6-phosphofructokinase, putative	0.0088	0.0098	0.1437
Schistosoma mansoni	phosphoglycerate kinase	0.0154	0.0203	0.1083
Loa Loa (eye worm)	hypothetical protein	0.0076	0.0079	0.0079
Trichomonas vaginalis	histone acetyltransferase gcn5, putative	0.0057	0.0049	0.0716
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.01	0.0118	0.0118
Schistosoma mansoni	zinc finger protein	0.0047	0.0034	0.0179
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0047	0.0034	0.05
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0279	0.0401	0.0401
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0047	0.0034	0.0287
Trypanosoma brucei	phosphoglycerate kinase	0.0154	0.0203	0.0521
Echinococcus multilocularis	transient receptor potential gamma protein	0.0093	0.0107	0.091
Trypanosoma brucei	oxidoreductase-like protein	0.0078	0.0082	0.0211
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.01	0.0118	0.0627
Echinococcus granulosus	geminin	0.045	0.0672	1
Leishmania major	pteridine reductase 1	0.1204	0.1866	0.4714
Trichomonas vaginalis	phosphofructokinase, putative	0.0326	0.0475	0.6963
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0053	0.0043	0.0043
Schistosoma mansoni	microsomal glutathione s-transferase	0.007	0.007	0.0371
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.01	0.0118	0.1005
Trichomonas vaginalis	bromodomain-containing protein, putative	0.008	0.0085	0.1239
Brugia malayi	RNA, U transporter 1	0.0074	0.0076	0.0076
Echinococcus multilocularis	Bromodomain containing protein	0.0057	0.0049	0.0418
Leishmania major	dehydrogenase/oxidoreductase-like protein	0.0078	0.0082	0.0088
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.1211	0.1878	1
Mycobacterium tuberculosis	Probable phosphoglycerate kinase Pgk	0.0154	0.0203	0.202
Trypanosoma cruzi	beta-ketoacyl-ACP reductase	0.0078	0.0082	0.0088
Brugia malayi	Nuclear hormone receptor E75	0.0047	0.0034	0.0034
Trichomonas vaginalis	phosphofructokinase, putative	0.0326	0.0475	0.6963
Echinococcus multilocularis	ecdysone induced protein 78C	0.01	0.0118	0.1005
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0047	0.0034	0.0287
Toxoplasma gondii	phosphoglycerate kinase PGKII	0.0154	0.0203	0.2983
Echinococcus granulosus	FTZ F1 alpha	0.01	0.0118	0.1752
Echinococcus multilocularis	tumor protein p63	0.0319	0.0464	0.396
Trichomonas vaginalis	conserved hypothetical protein	0.008	0.0085	0.1239
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0047	0.0034	0.05
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.01	0.0118	0.1752
Brugia malayi	6-phosphofructokinase	0.0326	0.0475	0.0475
Brugia malayi	hypothetical protein	0.0047	0.0034	0.0034
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Schistosoma mansoni	hypothetical protein	0.0062	0.0056	0.03
Schistosoma mansoni	hypothetical protein	0.0062	0.0056	0.03
Loa Loa (eye worm)	hypothetical protein	0.0133	0.017	0.017
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0031	0.0008	0.0068
Schistosoma mansoni	transcription factor LCR-F1	0.0029	0.0004	0.0023
Trichomonas vaginalis	bromodomain-containing protein, putative	0.008	0.0085	0.1239
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0057	0.0049	0.0716
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0326	0.0475	0.6547
Loa Loa (eye worm)	6-phosphofructokinase	0.0326	0.0475	0.0475
Trichomonas vaginalis	bromodomain-containing protein 4, brd4, putative	0.0057	0.0049	0.0716
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0107	0.0107
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.01	0.0118	0.1005
Loa Loa (eye worm)	hypothetical protein	0.01	0.0118	0.0118
Trichomonas vaginalis	bromodomain containing protein, putative	0.0057	0.0049	0.0716
Brugia malayi	hypothetical protein	0.0047	0.0034	0.0034
Echinococcus granulosus	TRP transient receptor potential channel	0.0036	0.0015	0.023
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0154	0.0203	0.0402
Mycobacterium ulcerans	phosphoglycerate kinase	0.0154	0.0203	0.202
Brugia malayi	latrophilin 2 splice variant baaae	0.0133	0.017	0.017
Schistosoma mansoni	bromodomain-containing protein 3 brd3	0.0128	0.0162	0.086
Echinococcus granulosus	thyroid hormone receptor alpha	0.0047	0.0034	0.05
Wolbachia endosymbiont of Brugia malayi	malonyl-CoA decarboxylase	0.6336	1	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.01	0.0118	0.0118
Schistosoma mansoni	nuclear receptor nhr-48	0.0047	0.0034	0.0179
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0047	0.0034	0.05
Wolbachia endosymbiont of Brugia malayi	phosphoglycerate kinase	0.0154	0.0203	0.0122
Trypanosoma brucei	pteridine reductase 1	0.1204	0.1866	0.478
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0056	0.0056
Echinococcus multilocularis	GPCR, family 2	0.0062	0.0056	0.0481
Loa Loa (eye worm)	steroid hormone receptor	0.01	0.0118	0.0118
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.01	0.0118	0.0627
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.01	0.0118	0.0627
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.01	0.0118	0.1752
Schistosoma mansoni	nuclear receptor	0.0047	0.0034	0.0179
Wolbachia endosymbiont of Brugia malayi	enoyl-ACP reductase	0.0456	0.0682	0.0605
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0088	0.0098	0.0263
Brugia malayi	Bromodomain containing protein	0.0128	0.0162	0.0162
Brugia malayi	hypothetical protein	0.0053	0.0043	0.0043
Entamoeba histolytica	phosphofructokinase, putative	0.0326	0.0475	1
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0047	0.0034	0.0034
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0047	0.0034	0.0034
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0062	0.0056	0.0481
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0047	0.0034	0.0287
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0034	0.0034
Loa Loa (eye worm)	nuclear hormone receptor	0.0047	0.0034	0.0034
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0043	0.0043
Trichomonas vaginalis	phosphofructokinase, putative	0.0326	0.0475	0.6963
Schistosoma mansoni	nuclear hormone receptor	0.0047	0.0034	0.0179
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0195	0.0268	0.0268
Giardia lamblia	Phosphoglycerate kinase	0.0154	0.0203	1
Plasmodium falciparum	enoyl-acyl carrier reductase	0.0456	0.0682	1
Schistosoma mansoni	hypothetical protein	0.045	0.0672	0.3576
Schistosoma mansoni	membrane associated proteins in eicosanoid and glutathione metabolism family member	0.007	0.007	0.0371
Plasmodium vivax	phosphoglycerate kinase, putative	0.0154	0.0203	0.2983
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.01	0.0118	0.0118
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0047	0.0034	0.05
Trichomonas vaginalis	phosphofructokinase, putative	0.0326	0.0475	0.6963
Trypanosoma brucei	beta-ketoacyl-ACP reductase	0.0078	0.0082	0.0211
Onchocerca volvulus		0.01	0.0118	1
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.249	0.3904	1
Toxoplasma gondii	2,4-dienoyl CoA reductase 2, peroxisomal family protein	0.0078	0.0082	0.1206
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0062	0.0056	0.0839
Brugia malayi	Transient-receptor-potential like protein	0.0036	0.0015	0.0015
Trichomonas vaginalis	conserved hypothetical protein	0.0057	0.0049	0.0716

Activities

Activity type	Activity value	Assay description	Source	Reference
MIC (functional)	= 0.39 ug ml-1	Antibacterial activity against Streptococcus pneumoniae ATCC 6301	ChEMBL.	16343900
MIC (functional)	= 0.39 ug ml-1	Antibacterial activity against Staphylococcus aureus ATCC 6538p	ChEMBL.	16343900
MIC (functional)	= 0.78 ug ml-1	Antibacterial activity against Streptococcus pneumoniae ATCC 700671	ChEMBL.	16343900
MIC (functional)	= 0.78 ug ml-1	Antibacterial activity against Streptococcus pneumoniae ATCC 49619	ChEMBL.	16343900
MIC (functional)	= 0.78 ug ml-1	Antibacterial activity against Staphylococcus aureus ATCC 29213	ChEMBL.	16343900
MIC (functional)	= 0.78 ug ml-1	Antibacterial activity against Staphylococcus epidermidis ATCC 12228	ChEMBL.	16343900
MIC (functional)	= 3.12 ug ml-1	Antibacterial activity against macrolide resistant Streptococcus pneumoniae ATCC 700676	ChEMBL.	16343900
MIC (functional)	= 3.12 ug ml-1	Antibacterial activity against macrolide resistant Streptococcus pneumoniae ATCC 700905	ChEMBL.	16343900
MIC (functional)	= 6.25 ug ml-1	Antibacterial activity against macrolide resistant Streptococcus pneumoniae ATCC 700677	ChEMBL.	16343900
MIC (functional)	= 6.25 ug ml-1	Antibacterial activity against macrolide resistant Staphylococcus aureus ATCC 141541	ChEMBL.	16343900
MIC (functional)	= 12.5 ug ml-1	Antibacterial activity against macrolide resistant Streptococcus pneumoniae ATCC 700906	ChEMBL.	16343900
MIC (functional)	> 12.5 ug ml-1	Antibacterial activity against macrolide resistant Staphylococcus aureus ATCC 33591	ChEMBL.	16343900
MIC (functional)	> 12.5 ug ml-1	Antibacterial activity against macrolide resistant Staphylococcus aureus ATCC BAA-39	ChEMBL.	16343900
MIC (functional)	> 12.5 ug ml-1	Antibacterial activity against macrolide resistant Staphylococcus aureus ATCC BAA-44	ChEMBL.	16343900
MIC (functional)	> 12.5 ug ml-1	Antibacterial activity against Enterococcus faecalis ATCC 51575	ChEMBL.	16343900

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: CHEMBL375413

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 408397