TDR Targets

Basic information

Technical information

TDR Targets ID: 1354138
Name: N-butyl-2-(4-methoxyphenyl)-4-phenylsulfonyl- 1,3-oxazol-5-amine
MW: 386.465 | Formula: C20H22N2O4S
H donors: 1 H acceptors: 3 LogP: 5.22 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCCCNc1oc(nc1S(=O)(=O)c1ccccc1)c1ccc(cc1)OC
InChi: 1S/C20H22N2O4S/c1-3-4-14-21-19-20(27(23,24)17-8-6-5-7-9-17)22-18(26-19)15-10-12-16(25-2)13-11-15/h5-13,21H,3-4,14H2,1-2H3
InChiKey: PHZRLIYOPMWAHX-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

N-butyl-2-(4-methoxyphenyl)-4-phenylsulfonyl-oxazol-5-amine
N-butyl-2-(4-methoxyphenyl)-4-phenylsulfonyl-5-oxazolamine
butyl-[2-(4-methoxyphenyl)-4-phenylsulfonyl-oxazol-5-yl]amine
SMR000144276
ZINC02866663
N-butyl-2-(4-methoxyphenyl)-4-(phenylsulfonyl)-1,3-oxazol-5-amine
MLS000538253

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470

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	nuclear receptor nhr-48	0.0158	0.1307	0.4081
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0335	0.3183	0.3173
Brugia malayi	orphan nuclear receptor NR2E1	0.0158	0.1307	0.4081
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0335	0.3183	1
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0335	0.3183	0.3173
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0158	0.1307	0.4081
Schistosoma mansoni	nuclear receptor	0.0158	0.1307	0.4081
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0335	0.3183	1
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0158	0.1307	0.4081
Brugia malayi	Nuclear hormone receptor E75	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.0092	0.029
Brugia malayi	Nuclear hormone receptor E75	0.0158	0.1307	0.4081
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0335	0.3183	1
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0158	0.1307	0.4081
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0158	0.1307	0.4081
Schistosoma mansoni	RAR-like nuclear receptor	0.0335	0.3183	1
Schistosoma mansoni	nuclear receptor	0.0158	0.1307	0.4081
Schistosoma mansoni	zinc finger protein	0.0158	0.1307	0.4081
Echinococcus granulosus	thyroid hormone receptor alpha	0.0158	0.1307	0.4107
Onchocerca volvulus		0.0286	0.2661	0.8354
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0335	0.3183	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0335	0.3183	0.3173
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0217	0.0641
Schistosoma mansoni	nuclear hormone receptor	0.0158	0.1307	0.4081
Brugia malayi	hypothetical protein	0.0158	0.1307	0.4081
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0335	0.3183	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0177	0.1508	0.4715
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0335	0.3183	0.3173
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0158	0.1307	0.1295
Brugia malayi	nuclear receptor NHR-88	0.0335	0.3183	1
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0158	0.1307	0.1295
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Brugia malayi	nuclear hormone receptor	0.0158	0.1307	0.4081
Brugia malayi	Nuclear hormone receptor-like 1	0.0335	0.3183	1
Entamoeba histolytica	hypothetical protein	0.0043	0.0092	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0335	0.3183	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0335	0.3183	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0335	0.3183	0.3173
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.0092	0.0247
Brugia malayi	hypothetical protein	0.0177	0.1508	0.4715
Loa Loa (eye worm)	hypothetical protein	0.0177	0.1508	0.4715
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0335	0.3183	0.3173
Brugia malayi	ecdysone receptor	0.0158	0.1307	0.4081
Brugia malayi	steroid hormone receptor	0.0335	0.3183	1
Brugia malayi	conserved hypotetical protein	0.0158	0.1307	0.4081
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0158	0.1307	0.4081
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0158	0.1307	0.1295
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0158	0.1307	0.4081
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0335	0.3183	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0335	0.3183	1
Brugia malayi	nuclear receptor NHR-88	0.0158	0.1307	0.4081
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0335	0.3183	1
Entamoeba histolytica	hypothetical protein	0.0043	0.0092	0.5
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0335	0.3183	1
Schistosoma mansoni	retinoic acid receptor RXR	0.0335	0.3183	1
Echinococcus granulosus	FTZ F1 alpha	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0177	0.1508	0.4715
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0217	0.0641
Entamoeba histolytica	hypothetical protein	0.0043	0.0092	0.5
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Loa Loa (eye worm)	nuclear hormone receptor	0.0158	0.1307	0.4081
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0158	0.1307	0.1295
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0158	0.1307	0.1295
Plasmodium vivax	SET domain protein, putative	0.0036	0.0014	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0217	0.0641
Schistosoma mansoni	nuclear hormone receptor	0.0335	0.3183	1
Brugia malayi	nuclear hormone receptor	0.0335	0.3183	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Brugia malayi	hypothetical protein	0.0177	0.1508	0.4715
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0335	0.3183	1
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.2661	0.5
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Brugia malayi	hypothetical protein	0.0043	0.0092	0.0247
Loa Loa (eye worm)	steroid hormone receptor	0.0335	0.3183	1
Schistosoma mansoni	thyroid hormone receptor	0.0335	0.3183	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0335	0.3183	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.2293	0.7194
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Schistosoma mansoni	hypothetical protein	0.0043	0.0092	0.0247
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Brugia malayi	nuclear receptor RXR	0.0177	0.1508	0.4715
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0217	0.0641
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0335	0.3183	1
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0177	0.1508	0.4715
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0158	0.1307	0.4081
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0335	0.3183	1
Brugia malayi	nuclear receptor NHR-67	0.0158	0.1307	0.4081
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0335	0.3183	1
Echinococcus multilocularis	nuclear receptor nhr 48	0.0158	0.1307	0.1295
Brugia malayi	tailless protein	0.0158	0.1307	0.4081
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.0092	0.0078
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0177	0.1508	0.1496
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Brugia malayi	hypothetical protein	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0177	0.1508	0.4715
Echinococcus granulosus	nuclear receptor nhr 48	0.0158	0.1307	0.4107
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0158	0.1307	0.4107
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0335	0.3183	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0217	0.0641
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0217	0.0682
Brugia malayi	nuclear hormone receptor family member odr-7	0.0158	0.1307	0.4081
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0177	0.1508	0.4715
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0335	0.3183	1
Echinococcus multilocularis	FTZ F1 alpha	0.0335	0.3183	0.3173
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0177	0.1508	0.4715
Loa Loa (eye worm)	hypothetical protein	0.0177	0.1508	0.4715
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Onchocerca volvulus	Bile acid receptor homolog	0.0335	0.3183	1
Brugia malayi	Steroid receptor seven-up type 2	0.0335	0.3183	1
Onchocerca volvulus		0.0158	0.1307	0.4081
Brugia malayi	ecdysteroid receptor	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0335	0.3183	1
Echinococcus granulosus	ecdysone induced protein 78C	0.0335	0.3183	1
Schistosoma mansoni	coup transcription factor	0.0335	0.3183	1
Brugia malayi	Pre-SET motif family protein	0.0251	0.2293	0.7194
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Schistosoma mansoni	nuclear hormone receptor	0.0158	0.1307	0.4081
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0177	0.1508	0.4738
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0335	0.3183	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0217	0.0203
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0158	0.1307	0.4107
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0335	0.3183	0.3173
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0335	0.3183	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0217	0.0203
Brugia malayi	nuclear receptor RXR	0.0158	0.1307	0.4081
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0335	0.3183	0.3173
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.0014	0.0044
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0335	0.3183	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0335	0.3183	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0036	0.0014	0.5
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0335	0.3183	1
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0177	0.1508	0.4715
Loa Loa (eye worm)	DR-78	0.0158	0.1307	0.4081
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1307	0.4081
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0335	0.3183	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0158	0.1307	0.4107
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0335	0.3183	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0158	0.1307	0.4107
Onchocerca volvulus		0.0158	0.1307	0.4081
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0335	0.3183	1
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0335	0.3183	1
Loa Loa (eye worm)	hypothetical protein	0.0335	0.3183	1
Entamoeba histolytica	hypothetical protein	0.0043	0.0092	0.5
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0217	0.0682
Onchocerca volvulus		0.0335	0.3183	1
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0177	0.1508	0.4715
Onchocerca volvulus	Protein ultraspiracle homolog	0.0335	0.3183	1
Schistosoma mansoni	thyroid hormone receptor	0.0335	0.3183	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0335	0.3183	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	2.8184 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	2.8184 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	10.3225 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	16.3535 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	16.3601 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	= 22.3872 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1476 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent))]	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)]	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))]	ChEMBL.	No reference
Potency (functional)	31.6228 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))]	ChEMBL.	No reference
Potency (binding)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	= 50.1187 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference
Potency (functional)	56.2341 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23

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: CHEMBL1460145

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1354138