TDR Targets

Basic information

Technical information

TDR Targets ID: 848334
Name: 3-methoxy-N'-phenylsulfonylbenzohydrazide
MW: 306.337 | Formula: C14H14N2O4S
H donors: 2 H acceptors: 3 LogP: 2.03 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1cccc(c1)C(=O)NNS(=O)(=O)c1ccccc1
InChi: 1S/C14H14N2O4S/c1-20-12-7-5-6-11(10-12)14(17)15-16-21(18,19)13-8-3-2-4-9-13/h2-10,16H,1H3,(H,15,17)
InChiKey: JTDNXIFAMDFYHZ-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

3-methoxy-N'-phenylsulfonyl-benzohydrazide
BAS 01190107
CBMicro_017893
BIM-0017666.P001
ZINC00325208

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
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 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 granulosus	guanine nucleotide binding protein Gs subunit	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
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	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	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

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
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Brugia malayi	Cathepsin L-like precursor	0.027	1	1
Loa Loa (eye worm)	hypothetical protein	0.0182	0.5946	0.5946
Echinococcus multilocularis	cysteine protease	0.027	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0141	0.4054	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0182	0.5946	0.5946
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0087	0.0087
Echinococcus multilocularis	cathepsin L	0.0141	0.4054	0.4054
Onchocerca volvulus		0.027	1	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0097	0.2032	0.2032
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.027	1	1
Loa Loa (eye worm)	hypothetical protein	0.0195	0.657	0.657
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0141	0.4054	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0141	0.4054	0.2538
Leishmania major	cathepsin L-like protease	0.027	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.1588	0.1588
Entamoeba histolytica	cysteine proteinase, putative	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Onchocerca volvulus	Cathepsin L homolog	0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0182	0.5946	0.5946
Echinococcus multilocularis	cathepsin b	0.0195	0.657	0.657
Schistosoma mansoni	cathepsin F (C01 family)	0.027	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.027	1	1
Plasmodium vivax	unspecified product	0.0088	0.1588	0.1588
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Loa Loa (eye worm)	cysteine protease	0.027	1	1
Loa Loa (eye worm)	hypothetical protein	0.0088	0.1588	0.1588
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Brugia malayi	cathepsin L-like precursor	0.0182	0.5946	0.5946
Toxoplasma gondii	cathepsin B	0.0097	0.2032	0.2032
Onchocerca volvulus		0.027	1	1
Echinococcus granulosus	cathepsin L	0.0141	0.4054	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.0141	0.4054	0.4054
Echinococcus granulosus	cathepsin b	0.0195	0.657	0.657
Loa Loa (eye worm)	cathepsin B	0.0097	0.2032	0.2032
Onchocerca volvulus		0.027	1	1
Plasmodium vivax	vivapain-3	0.0141	0.4054	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0141	0.4054	0.4054
Loa Loa (eye worm)	fibroinase	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0097	0.2032	0.2032
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0087	0.0087
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0087	0.0087
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0141	0.4054	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Onchocerca volvulus		0.027	1	1
Brugia malayi	Cathepsin L-like precursor	0.027	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0087	0.0087
Leishmania major	cysteine peptidase A (CPA)	0.027	1	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0088	0.1588	0.1588
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.027	1	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0141	0.4054	0.4054
Echinococcus granulosus	cathepsin l1	0.0182	0.5946	0.5946
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Plasmodium vivax	vivapain-1	0.0141	0.4054	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0141	0.4054	0.2538
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Onchocerca volvulus		0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0141	0.4054	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0182	0.5946	0.5946
Trypanosoma cruzi	cysteine peptidase, putative	0.027	1	1
Plasmodium vivax	unspecified product	0.0141	0.4054	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.027	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0195	0.657	0.657
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0087	0.0087
Entamoeba histolytica	cysteine proteinase, putative	0.027	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.027	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0088	0.1588	0.1588
Brugia malayi	cathepsin B-like cysteine proteinase	0.0195	0.657	0.657
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Onchocerca volvulus	Cathepsin L homolog	0.027	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Giardia lamblia	Cathepsin B precursor	0.0097	0.2032	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Entamoeba histolytica	cysteine proteinase 2	0.0141	0.4054	0.4054
Onchocerca volvulus		0.027	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0141	0.4054	0.4054
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0141	0.4054	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0182	0.5946	0.5946
Trypanosoma cruzi	cysteine protease, putative	0.0141	0.4054	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0195	0.657	0.657
Loa Loa (eye worm)	hypothetical protein	0.0088	0.1588	0.1588
Toxoplasma gondii	cathepsin CPL	0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trypanosoma cruzi	cysteine proteinase, putative	0.0141	0.4054	0.4054
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0195	0.657	0.657
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0141	0.4054	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0182	0.5946	0.5946
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.027	1	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0088	0.1588	0.1588
Brugia malayi	Cathepsin L-like precursor	0.027	1	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.0141	0.4054	0.4054
Echinococcus multilocularis	cathepsin b	0.0195	0.657	0.657
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Echinococcus granulosus	cathepsin l1	0.027	1	1
Giardia lamblia	Cathepsin B precursor	0.0097	0.2032	1
Echinococcus granulosus	cathepsin b	0.0195	0.657	0.657
Loa Loa (eye worm)	cytochrome P450 family protein	0.006	0.0289	0.0289
Schistosoma mansoni	cathepsin s	0.0088	0.1588	0.1588
Loa Loa (eye worm)	hypothetical protein	0.027	1	1
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0182	0.5946	0.5946
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Onchocerca volvulus	Cathepsin F homolog	0.027	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0141	0.4054	0.4054
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0087	0.0087
Loa Loa (eye worm)	ctsf protein	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.027	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0195	0.657	0.657
Entamoeba histolytica	cysteine proteinase, putative	0.0182	0.5946	0.5946
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.027	1	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0141	0.4054	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0097	0.2032	0.2032
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0087	0.0087
Leishmania major	cathepsin L-like protease	0.027	1	1
Plasmodium vivax	vivapain-2	0.027	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Plasmodium vivax	vivapain-2	0.027	1	1
Giardia lamblia	Cathepsin B precursor	0.0097	0.2032	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0087	0.0087
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0141	0.4054	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0141	0.4054	0.4054
Trypanosoma cruzi	cruzipain precursor, putative	0.027	1	1
Brugia malayi	Cathepsin L-like precursor	0.0182	0.5946	0.5946
Brugia malayi	Cathepsin L-like precursor	0.0182	0.5946	0.5946
Brugia malayi	Cathepsin L-like precursor	0.027	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0141	0.4054	0.4054
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0087	0.0087
Onchocerca volvulus		0.027	1	1
Brugia malayi	Cathepsin L-like precursor	0.027	1	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0141	0.4054	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0088	0.1588	0.1588
Plasmodium falciparum	cysteine proteinase falcipain 3	0.027	1	1
Echinococcus multilocularis	cysteine protease	0.027	1	1
Echinococcus granulosus	cysteine protease	0.0141	0.4054	0.4054
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0195	0.657	0.657
Brugia malayi	Cytochrome P450 family protein	0.006	0.0289	0.0289
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0088	0.1588	0.1588
Loa Loa (eye worm)	hypothetical protein	0.0182	0.5946	0.5946
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0088	0.1588	0.1588
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Leishmania major	cathepsin L-like protease	0.027	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.027	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0141	0.4054	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.027	1	1
Onchocerca volvulus		0.0182	0.5946	0.5946

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	6.3096 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)	39.8107 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	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: CHEMBL2142778
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Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 848334