TDR Targets

Basic information

Technical information

TDR Targets ID: 1402779
Name: ZINC02631013
MW: 366.437 | Formula: C19H18N4O2S
H donors: 0 H acceptors: 3 LogP: 3.37 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: Cc1onc(c1CSc1nnc(n1Cc1ccco1)c1ccccc1)C
InChi: 1S/C19H18N4O2S/c1-13-17(14(2)25-22-13)12-26-19-21-20-18(15-7-4-3-5-8-15)23(19)11-16-9-6-10-24-16/h3-10H,11-12H2,1-2H3
InChiKey: XEVWYTOKVJVRIY-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

T5276254
MLS000097420
SMR000067689

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references
Homo sapiens	huntingtin	Starlite/ChEMBL	No references
Homo sapiens	thyroid stimulating hormone receptor	Starlite/ChEMBL	No references
Homo sapiens	microtubule-associated protein tau	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04380 microtubule-associated protein tau, putative	Get druggable targets OG5_133504	All targets in OG5_133504
Brugia malayi	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Brugia malayi	follicle stimulating hormone receptor	Get druggable targets OG5_130089	All targets in OG5_130089
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Onchocerca volvulus	Huntingtin homolog	Get druggable targets OG5_132837	All targets in OG5_132837
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Onchocerca volvulus	Huntingtin homolog	Get druggable targets OG5_132837	All targets in OG5_132837
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225
Loa Loa (eye worm)	follicle stimulating hormone receptor	Get druggable targets OG5_130089	All targets in OG5_130089
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504
Schistosoma mansoni	microtubule-associated protein tau	Get druggable targets OG5_133504	All targets in OG5_133504

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Echinococcus multilocularis	cysteine protease	0.0762	0.2822	0.2822
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Echinococcus granulosus	cathepsin L cysteine protease	0.0423	0.1144	0.1144
Plasmodium vivax	vivapain-2	0.0762	0.2822	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0762	0.2822	0.9123
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Entamoeba histolytica	cysteine proteinase, putative	0.0423	0.1144	0.4054
Brugia malayi	cathepsin L-like precursor	0.0531	0.1678	0.1678
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0762	0.2822	1
Brugia malayi	Papain family cysteine protease containing protein	0.0423	0.1144	0.1144
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0423	0.1144	0.3698
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0531	0.1678	0.1678
Echinococcus granulosus	cysteine protease	0.0423	0.1144	0.1144
Brugia malayi	Cathepsin L-like precursor	0.0531	0.1678	0.1678
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0762	0.2822	0.2822
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Plasmodium vivax	unspecified product	0.0423	0.1144	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.0231	0.0196	0.0196
Onchocerca volvulus	Cathepsin L homolog	0.0762	0.2822	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0817	0.3093	1
Brugia malayi	follicle stimulating hormone receptor	0.028	0.0435	0.0435
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0231	0.0196	0.0196
Entamoeba histolytica	cysteine proteinase, putative	0.0423	0.1144	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0762	0.2822	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.0423	0.1144	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Echinococcus multilocularis	cathepsin L cysteine protease	0.0762	0.2822	0.2822
Loa Loa (eye worm)	fibroinase	0.0762	0.2822	0.2822
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Schistosoma mansoni	cathepsin F (C01 family)	0.0762	0.2822	0.2822
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Onchocerca volvulus		0.0762	0.2822	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0762	0.2822	1
Giardia lamblia	Cathepsin B precursor	0.0817	0.3093	1
Echinococcus multilocularis	microtubule associated protein 2	0.0833	0.3174	0.3174
Onchocerca volvulus		0.0762	0.2822	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0817	0.3093	0.3093
Entamoeba histolytica	cysteine proteinase, putative	0.0423	0.1144	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0231	0.0196	0.0196
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Trypanosoma cruzi	cysteine peptidase, putative	0.0423	0.1144	0.1144
Loa Loa (eye worm)	hypothetical protein	0.0531	0.1678	0.1678
Trypanosoma cruzi	cysteine peptidase, putative	0.0762	0.2822	0.2822
Loa Loa (eye worm)	cathepsin B	0.0817	0.3093	0.3093
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Trypanosoma cruzi	cysteine peptidase, putative	0.0762	0.2822	0.2822
Echinococcus granulosus	cathepsin l1	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Onchocerca volvulus		0.0762	0.2822	1
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.028	0.0435	0.0435
Loa Loa (eye worm)	ctsf protein	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Onchocerca volvulus		0.0531	0.1678	0.5946
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0423	0.1144	0.1144
Onchocerca volvulus		0.0762	0.2822	1
Onchocerca volvulus		0.0762	0.2822	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0423	0.1144	0.1144
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.0762	0.2822	0.2822
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Giardia lamblia	Cathepsin B precursor	0.0817	0.3093	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Onchocerca volvulus		0.0762	0.2822	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Plasmodium vivax	vivapain-1	0.0423	0.1144	0.4054
Trypanosoma cruzi	cruzipain precursor, putative	0.0231	0.0196	0.0196
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Schistosoma mansoni	microtubule-associated protein tau	0.0833	0.3174	0.3174
Plasmodium vivax	vivapain-3	0.0423	0.1144	0.4054
Echinococcus granulosus	cathepsin l1	0.0531	0.1678	0.1678
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0531	0.1678	0.5424
Onchocerca volvulus	Cathepsin L homolog	0.0762	0.2822	1
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Echinococcus granulosus	cathepsin L	0.0423	0.1144	0.1144
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0762	0.2822	0.9123
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0979	0.3895	0.3895
Entamoeba histolytica	cysteine proteinase, putative	0.0423	0.1144	0.4054
Echinococcus multilocularis	cathepsin L	0.0423	0.1144	0.1144
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0531	0.1678	0.1678
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0423	0.1144	0.1144
Loa Loa (eye worm)	hypothetical protein	0.0231	0.0196	0.0196
Onchocerca volvulus		0.0762	0.2822	1
Onchocerca volvulus	Cathepsin F homolog	0.0762	0.2822	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0423	0.1144	0.1144
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0531	0.1678	0.1678
Loa Loa (eye worm)	hypothetical protein	0.0762	0.2822	0.2822
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0762	0.2822	0.2822
Trypanosoma cruzi	cruzipain precursor, putative	0.0762	0.2822	0.2822
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Trypanosoma cruzi	cysteine protease, putative	0.0423	0.1144	0.1144
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0531	0.1678	0.1678
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0762	0.2822	0.2822
Trypanosoma cruzi	cysteine peptidase, putative	0.0762	0.2822	0.2822
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0231	0.0196	0.0196
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Echinococcus multilocularis	cysteine protease	0.0762	0.2822	0.2822
Loa Loa (eye worm)	hypothetical protein	0.0231	0.0196	0.0196
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Echinococcus granulosus	microtubule associated protein 2	0.0833	0.3174	0.3174
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0531	0.1678	0.5424
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Plasmodium vivax	vivapain-2	0.0762	0.2822	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Giardia lamblia	Cathepsin B precursor	0.0817	0.3093	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0231	0.0196	0.0196
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0817	0.3093	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0423	0.1144	0.4054
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Entamoeba histolytica	cysteine proteinase, putative	0.0531	0.1678	0.5946
Entamoeba histolytica	cysteine proteinase, putative	0.0762	0.2822	1
Entamoeba histolytica	cysteine proteinase 2	0.0423	0.1144	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0423	0.1144	0.1144
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0423	0.1144	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0762	0.2822	0.9123
Toxoplasma gondii	cathepsin CPL	0.0762	0.2822	0.9123
Loa Loa (eye worm)	cysteine protease	0.0762	0.2822	0.2822
Brugia malayi	Papain family cysteine protease containing protein	0.0762	0.2822	0.2822
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0762	0.2822	0.8608
Schistosoma mansoni	cathepsin F (C01 family)	0.0531	0.1678	0.1678
Entamoeba histolytica	cysteine proteinase, putative	0.0762	0.2822	1
Schistosoma mansoni	cathepsin s	0.0231	0.0196	0.0196
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0423	0.1144	0.1144
Plasmodium vivax	unspecified product	0.0231	0.0196	0.0695
Loa Loa (eye worm)	hypothetical protein	0.0531	0.1678	0.1678
Brugia malayi	Cathepsin L-like precursor	0.0762	0.2822	0.2822
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0762	0.2822	0.2822
Toxoplasma gondii	cathepsin B	0.0817	0.3093	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Brugia malayi	cathepsin F-like cysteine proteinase	0.0231	0.0196	0.0196
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0762	0.2822	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0817	0.3093	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0423	0.1144	0.3698
Echinococcus multilocularis	cathepsin L cysteine protease	0.0762	0.2822	0.2822
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0762	0.2822	0.9123
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0817	0.3093	0.3093
Brugia malayi	Papain family cysteine protease containing protein	0.0423	0.1144	0.1144

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 8.9125 um	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	= 10 um	PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.9953 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)	= 15.8489 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 15.8489 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	18.3564 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143]	ChEMBL.	No reference
Potency (functional)	22.3872 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
Potency (functional)	35.4813 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 39.8107 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)	= 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)	= 56.2341 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)	= 56.2341 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

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: CHEMBL1563284

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1402779