Detailed information for compound 1264672

Basic information

Technical information
  • TDR Targets ID: 1264672
  • Name: N-[4-(furan-2-ylmethylcarbamothioyl)phenyl]ac etamide
  • MW: 274.338 | Formula: C14H14N2O2S
  • H donors: 1 H acceptors: 1 LogP: 2.01 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Nc1ccc(cc1)C(=NCc1ccco1)S
  • InChi: 1S/C14H14N2O2S/c1-10(17)16-12-6-4-11(5-7-12)14(19)15-9-13-3-2-8-18-13/h2-8H,9H2,1H3,(H,15,19)(H,16,17)
  • InChiKey: VRLBEDQEHFAPQY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-(2-furylmethylcarbamothioyl)phenyl]acetamide
  • N-[4-[(2-furylmethylamino)-thioxomethyl]phenyl]acetamide
  • N-[4-(2-furylmethylthiocarbamoyl)phenyl]acetamide
  • N-[4-(furan-2-ylmethylcarbamothioyl)phenyl]ethanamide
  • MLS000572212
  • SMR000151247
  • T5320409
  • ZINC03348887

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens hydroxyprostaglandin dehydrogenase 15-(NAD) Starlite/ChEMBL No references
Homo sapiens snurportin 1 No references
Homo sapiens karyopherin (importin) beta 1 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis guanine nucleotide binding protein G(s) 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
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
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
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, 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
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
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
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
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 %
Plasmodium falciparum steroid dehydrogenase, putative hydroxyprostaglandin dehydrogenase 15-(NAD) 266 aa 216 aa 22.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi beta-lactamase family protein 0.0036 0.0518 0.2262
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0435 0.0489
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0491 0.0537
Echinococcus multilocularis lamin 0.0033 0.0435 0.0473
Onchocerca volvulus 0.0036 0.0518 1
Trypanosoma cruzi O-6 methyl-guanine alkyl transferase, putative 0.0137 0.3037 1
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0435 0.1854
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Echinococcus multilocularis lamin dm0 0.0033 0.0435 0.0473
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0435 0.0489
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1001 0.111
Brugia malayi beta-lactamase family protein 0.0036 0.0518 0.2262
Trypanosoma cruzi O-6 methyl-guanine alkyl transferase, putative 0.0137 0.3037 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Treponema pallidum methylated-DNA-protein-cysteine S-methyltransferase (dat) 0.0137 0.3037 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1001 0.0668
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.8894 1
Brugia malayi Importin beta-1 subunit 0.0035 0.0491 0.213
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0058 0.0065
Loa Loa (eye worm) hypothetical protein 0.0032 0.042 0.0473
Entamoeba histolytica hypothetical protein 0.0028 0.0327 0.5
Onchocerca volvulus 0.0036 0.0518 1
Echinococcus granulosus lamin 0.0033 0.0435 0.0473
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1001 0.4633
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Loa Loa (eye worm) hypothetical protein 0.0016 0.0015 0.0017
Brugia malayi intermediate filament protein 0.0033 0.0435 0.1854
Plasmodium falciparum importin beta, putative 0.0035 0.0491 0.5
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0518 0.0583
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0518 0.0705
Brugia malayi RNA, U transporter 1 0.0099 0.2093 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Echinococcus granulosus intermediate filament protein 0.0033 0.0435 0.0473
Loa Loa (eye worm) beta-lactamase 0.0036 0.0518 0.0583
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0518 0.0705
Brugia malayi beta-lactamase 0.0036 0.0518 0.2262
Echinococcus granulosus snurportin 1 0.0372 0.8894 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0518 0.0098
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0518 0.2262
Echinococcus granulosus lamin dm0 0.0033 0.0435 0.0473
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0518 0.0515
Trichomonas vaginalis methylated-DNA--protein-cysteine methyltransferase, putative 0.0137 0.3037 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1001 0.111
Loa Loa (eye worm) hypothetical protein 0.0035 0.0491 0.0552
Chlamydia trachomatis methylated-DNA protein-cysteine methyltransferase 0.0137 0.3037 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0056 0.1011 1
Toxoplasma gondii ABC1 family protein 0.0036 0.0518 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1001 0.111
Echinococcus granulosus importin subunit beta 1 0.0035 0.0491 0.0537
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0518 0.0705
Loa Loa (eye worm) hypothetical protein 0.0036 0.0518 0.0583
Mycobacterium tuberculosis Methylated-DNA--protein-cysteine methyltransferase Ogt (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA-alkyltra 0.0416 1 1
Echinococcus multilocularis snurportin 1 0.0372 0.8894 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0518 0.0705
Schistosoma mansoni hypothetical protein 0.0372 0.8894 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0229 0.5343 0.5088
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0518 0.0705
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1001 0.1125
Leishmania major hypothetical protein, conserved 0.0036 0.0518 0.0705
Onchocerca volvulus 0.0036 0.0518 1
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0518 0.0705
Loa Loa (eye worm) hypothetical protein 0.0033 0.0435 0.0489
Mycobacterium ulcerans methylated-DNA--protein-cysteine methyltransferase Ogt 0.0416 1 1
Schistosoma mansoni importin beta-1 0.0035 0.0491 0.0066
Echinococcus multilocularis musashi 0.0033 0.0435 0.0473
Trichomonas vaginalis esterase, putative 0.0036 0.0518 0.0705
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1001 0.0668
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0518 0.0567
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1001 0.0668
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0518 0.0098
Mycobacterium ulcerans DNA-methyltransferase (modification methylase) 0.0056 0.1011 0.052
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1001 0.111
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0518 0.0705
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0518 0.0567
Leishmania major hypothetical protein, conserved 0.0137 0.3037 1
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0518 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.5849 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) 8.9125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 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) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 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) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] 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

Bibliographic References

No literature references available for this target.

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