TDR Targets

Basic information

Technical information

TDR Targets ID: 764484
Name: 3-[5-[(E)-(carbamothioylhydrazinylidene)methy l]furan-2-yl]benzoic acid
MW: 289.31 | Formula: C13H11N3O3S
H donors: 3 H acceptors: 2 LogP: 1.79 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: NC(=S)N/N=C/c1ccc(o1)c1cccc(c1)C(=O)O
InChi: 1S/C13H11N3O3S/c14-13(20)16-15-7-10-4-5-11(19-10)8-2-1-3-9(6-8)12(17)18/h1-7H,(H,17,18)(H3,14,16,20)/b15-7+
InChiKey: YAAQQGFFRHANNZ-VIZOYTHASA-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-[5-[(carbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid
3-[5-[(carbamothioylhydrazono)methyl]-2-furyl]benzoic acid
3-[5-[(E)-(carbamothioylhydrazono)methyl]-2-furyl]benzoic acid
3-[5-[(thiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid
3-[5-[(E)-(thiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid
ST057051

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
Schistosoma mansoni	hypothetical protein	0.0032	0.001	0.001
Plasmodium vivax	hypothetical protein, conserved	0.0072	0.0039	1
Brugia malayi	beta-lactamase family protein	0.0072	0.0039	0.0039
Schistosoma mansoni	hypothetical protein	0.0035	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0003	0.0003
Brugia malayi	RNA recognition motif domain containing protein	0.0127	0.0081	0.0081
Schistosoma mansoni	smad	0.0044	0.0018	0.0018
Entamoeba histolytica	hypothetical protein	0.0035	0.0011	0.5
Brugia malayi	TAR-binding protein	0.0127	0.0081	0.0081
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0037	0.0013	0.0013
Loa Loa (eye worm)	hypothetical protein	0.007	0.0038	0.0038
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0037	0.0013	0.0013
Brugia malayi	MH1 domain containing protein	0.0044	0.0018	0.0018
Mycobacterium leprae	Probable lipase LipE	0.0072	0.0039	0.5
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0099	0.0059	0.0059
Schistosoma mansoni	cellular tumor antigen P53	0.0162	0.0107	0.0107
Brugia malayi	beta-lactamase	0.0072	0.0039	0.0039
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0072	0.0039	0.5
Brugia malayi	beta-lactamase family protein	0.0072	0.0039	0.0039
Loa Loa (eye worm)	MH2 domain-containing protein	0.0645	0.0469	0.0469
Echinococcus multilocularis	PHD finger protein rhinoceros	0.003	0.0008	0.0008
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0072	0.0039	0.0039
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0103	0.0062	0.0062
Mycobacterium ulcerans	lipase LipD	0.0072	0.0039	0.5
Loa Loa (eye worm)	hypothetical protein	0.0162	0.0107	0.0107
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.003	0.0008	0.0008
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0099	0.0059	0.0059
Onchocerca volvulus		0.0162	0.0107	0.0107
Trichomonas vaginalis	penicillin-binding protein, putative	0.0072	0.0039	0.5
Brugia malayi	MH1 domain containing protein	0.0024	0.0003	0.0003
Echinococcus multilocularis	sodium bile acid cotransporter	1.3341	1	1
Brugia malayi	Cytochrome P450 family protein	0.0025	0.0004	0.0004
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.001	0.001
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.001	0.001
Schistosoma mansoni	hypothetical protein	0.0032	0.001	0.001
Echinococcus granulosus	sodium bile acid cotransporter	1.3341	1	1
Trypanosoma brucei	hypothetical protein, conserved	0.0072	0.0039	0.5
Mycobacterium ulcerans	beta-lactamase	0.0072	0.0039	0.5
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.0039	0.5
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0011	0.0011
Mycobacterium ulcerans	esterase/lipase LipP	0.0072	0.0039	0.5
Schistosoma mansoni	smad1 5 8 and	0.0044	0.0018	0.0018
Onchocerca volvulus		0.0072	0.0039	0.0039
Schistosoma mansoni	tar DNA-binding protein	0.0127	0.0081	0.0081
Entamoeba histolytica	hypothetical protein	0.0035	0.0011	0.5
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0011	0.0011
Onchocerca volvulus		0.0072	0.0039	0.0039
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.001	0.001
Loa Loa (eye worm)	nuclear factor I	0.0024	0.0003	0.0003
Loa Loa (eye worm)	MH2 domain-containing protein	0.0044	0.0018	0.0018
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0461	0.0332	1
Brugia malayi	MH2 domain containing protein	0.0645	0.0469	0.0469
Loa Loa (eye worm)	hypothetical protein	0.0032	0.001	0.001
Schistosoma mansoni	sodium-bile acid cotransporter	0.7932	0.5939	0.5939
Schistosoma mansoni	tar DNA-binding protein	0.0127	0.0081	0.0081
Brugia malayi	MH1 domain containing protein	0.0044	0.0018	0.0018
Mycobacterium ulcerans	hypothetical protein	0.0072	0.0039	0.5
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0072	0.0039	0.0039
Echinococcus multilocularis	sodium bile acid cotransporter	1.3341	1	1
Echinococcus granulosus	tar DNA binding protein	0.0127	0.0081	0.0081
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0024	0.0024
Echinococcus granulosus	sodium bile acid cotransporter	1.3341	1	1
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0044	0.0018	0.0018
Brugia malayi	RNA binding protein	0.0127	0.0081	0.0081
Loa Loa (eye worm)	RNA binding protein	0.0127	0.0081	0.0081
Schistosoma mansoni	jumonji domain containing protein	0.0079	0.0044	0.0044
Trypanosoma cruzi	hypothetical protein, conserved	0.0072	0.0039	0.5
Brugia malayi	MH1 domain containing protein	0.0024	0.0003	0.0003
Schistosoma mansoni	tar DNA-binding protein	0.0127	0.0081	0.0081
Loa Loa (eye worm)	jmjC domain-containing protein	0.0062	0.0032	0.0032
Loa Loa (eye worm)	jmjC domain-containing protein	0.0037	0.0013	0.0013
Giardia lamblia	PHD finger protein 15	0.003	0.0008	0.5
Schistosoma mansoni	sodium-bile acid cotransporter related	1.3341	1	1
Loa Loa (eye worm)	hypothetical protein	1.3341	1	1
Onchocerca volvulus		1.3341	1	1
Loa Loa (eye worm)	beta-lactamase	0.0072	0.0039	0.0039
Echinococcus granulosus	tumor protein p63	0.1107	0.0816	0.0816
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0011	0.0011
Echinococcus multilocularis	GPCR, family 2	0.0032	0.001	0.001
Echinococcus multilocularis	sodium bile acid cotransporter	1.3341	1	1
Brugia malayi	Smad1	0.0044	0.0018	0.0018
Echinococcus granulosus	microtubule associated protein 2	0.2296	0.1709	0.1709
Brugia malayi	MH2 domain containing protein	0.0044	0.0018	0.0018
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0127	0.0081	0.0081
Brugia malayi	hypothetical protein	0.0035	0.0011	0.0011
Brugia malayi	MH2 domain containing protein	0.0044	0.0018	0.0018
Echinococcus multilocularis	tar DNA binding protein	0.0127	0.0081	0.0081
Echinococcus multilocularis	jumonji domain containing protein	0.0042	0.0017	0.0017
Leishmania major	hypothetical protein, conserved	0.0072	0.0039	0.5
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0072	0.0039	0.0039
Schistosoma mansoni	smad1 5 8 and	0.0044	0.0018	0.0018
Echinococcus multilocularis	Smad4	0.0044	0.0018	0.0018
Schistosoma mansoni	microtubule-associated protein tau	0.2296	0.1709	0.1709
Echinococcus granulosus	jumonji domain containing protein	0.0042	0.0017	0.0017
Onchocerca volvulus	Alhambra homolog	0.003	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.003	0.0008	0.0008
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.0039	0.5
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Schistosoma mansoni	sodium-bile acid cotransporter related	0.541	0.4046	0.4046
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.001	0.001
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0044	0.0018	0.0018
Entamoeba histolytica	hypothetical protein	0.0035	0.0011	0.5
Loa Loa (eye worm)	cytochrome P450 family protein	0.0025	0.0004	0.0004
Echinococcus granulosus	lysine specific demethylase 5A	0.0037	0.0013	0.0013
Trypanosoma cruzi	hypothetical protein, conserved	0.0072	0.0039	0.5
Schistosoma mansoni	hypothetical protein	0.007	0.0038	0.0038
Schistosoma mansoni	tar DNA-binding protein	0.0127	0.0081	0.0081
Schistosoma mansoni	hypothetical protein	0.003	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Plasmodium falciparum	phd finger protein, putative	0.003	0.0008	0.5
Entamoeba histolytica	hypothetical protein	0.0035	0.0011	0.5
Echinococcus granulosus	peregrin	0.003	0.0008	0.0008
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0044	0.0018	0.0018
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0103	0.0062	0.0062
Brugia malayi	jmjC domain containing protein	0.0037	0.0013	0.0013
Brugia malayi	latrophilin 2 splice variant baaae	0.007	0.0038	0.0038
Schistosoma mansoni	Smad4	0.0044	0.0018	0.0018
Brugia malayi	jmjC domain containing protein	0.0099	0.0059	0.0059
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.001	0.001
Echinococcus multilocularis	microtubule associated protein 2	0.2296	0.1709	0.1709
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0072	0.0039	0.0039
Echinococcus granulosus	PHD finger protein rhinoceros	0.003	0.0008	0.0008
Loa Loa (eye worm)	transcription factor SMAD2	0.0645	0.0469	0.0469
Echinococcus multilocularis	smad	0.0044	0.0018	0.0018
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0044	0.0018	0.0018
Echinococcus granulosus	sodium bile acid cotransporter	1.3341	1	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.0039	0.5
Echinococcus granulosus	beta LACTamase domain containing family member	0.0072	0.0039	0.0039
Loa Loa (eye worm)	PHD-finger family protein	0.003	0.0008	0.0008
Loa Loa (eye worm)	TAR-binding protein	0.0127	0.0081	0.0081
Trichomonas vaginalis	esterase, putative	0.0072	0.0039	0.5
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.001	0.001
Echinococcus granulosus	mothers against decapentaplegic 5	0.0044	0.0018	0.0018
Echinococcus multilocularis	peregrin	0.003	0.0008	0.0008
Toxoplasma gondii	ABC1 family protein	0.0072	0.0039	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0103	0.0062	0.0062
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Loa Loa (eye worm)	MH1 domain-containing protein	0.0044	0.0018	0.0018
Schistosoma mansoni	smad1 5 8 and	0.0044	0.0018	0.0018
Brugia malayi	PHD-finger family protein	0.003	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0103	0.0062	0.0062
Loa Loa (eye worm)	Smad1	0.0044	0.0018	0.0018
Mycobacterium leprae	conserved hypothetical protein	0.0072	0.0039	0.5
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.001	0.001
Echinococcus granulosus	Smad4	0.0044	0.0018	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0039	0.0039
Schistosoma mansoni	hypothetical protein	0.0032	0.001	0.001
Schistosoma mansoni	hypothetical protein	0.0032	0.001	0.001
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0072	0.0039	0.0039
Trichomonas vaginalis	penicillin-binding protein, putative	0.0072	0.0039	0.5
Brugia malayi	Bromodomain containing protein	0.003	0.0008	0.0008
Echinococcus granulosus	smad	0.0044	0.0018	0.0018
Schistosoma mansoni	tar DNA-binding protein	0.0127	0.0081	0.0081
Echinococcus multilocularis	lysine specific demethylase 5A	0.0037	0.0013	0.0013
Onchocerca volvulus		0.0072	0.0039	0.0039
Echinococcus granulosus	GPCR family 2	0.0032	0.001	0.001
Echinococcus multilocularis	tumor protein p63	0.1107	0.0816	0.0816

Activities

No activities found for this compound.

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 764484