Detailed information for compound 668174

Basic information

Technical information
  • TDR Targets ID: 668174
  • Name: 2-[5-(4-chlorophenyl)-4-oxothieno[2,3-d]pyrim idin-3-yl]-N-(furan-2-ylmethyl)acetamide
  • MW: 399.851 | Formula: C19H14ClN3O3S
  • H donors: 1 H acceptors: 2 LogP: 3.1 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Cn1cnc2c(c1=O)c(cs2)c1ccc(cc1)Cl)NCc1ccco1
  • InChi: 1S/C19H14ClN3O3S/c20-13-5-3-12(4-6-13)15-10-27-18-17(15)19(25)23(11-22-18)9-16(24)21-8-14-2-1-7-26-14/h1-7,10-11H,8-9H2,(H,21,24)
  • InChiKey: PEVOOBKBGLTYGE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[5-(4-chlorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-(2-furylmethyl)acetamide
  • 2-[5-(4-chlorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-(2-furylmethyl)acetamide
  • 2-[5-(4-chlorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]-N-(2-furylmethyl)acetamide
  • 2-[5-(4-chlorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-(furan-2-ylmethyl)ethanamide
  • Oprea1_236205
  • ZINC00921254
  • Oprea1_447049
  • BAS 03754385
  • STOCK3S-49871

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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Giardia lamblia Flap structure-specific endonuclease 0.0027 0.312 0.5
Schistosoma mansoni tar DNA-binding protein 0.0064 1 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.5061 0.5061
Loa Loa (eye worm) RNA binding protein 0.0064 1 1
Echinococcus granulosus flap endonuclease 1 0.0027 0.312 0.312
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0027 0.312 0.1907
Brugia malayi hypothetical protein 0.0017 0.1211 0.1211
Schistosoma mansoni flap endonuclease-1 0.0025 0.2631 0.2631
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Brugia malayi isocitrate dehydrogenase 0.0031 0.3812 0.3812
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.7494 0.7494
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.002 0.1685 0.1685
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.5061 0.5061
Schistosoma mansoni hypothetical protein 0.0016 0.1025 0.1025
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.002 0.1685 0.1685
Onchocerca volvulus 0.002 0.1685 1
Echinococcus granulosus GPCR family 2 0.0016 0.1025 0.1025
Loa Loa (eye worm) hypothetical protein 0.0035 0.45 0.45
Entamoeba histolytica hypothetical protein 0.0038 0.5061 1
Echinococcus multilocularis flap endonuclease 1 0.0027 0.312 0.312
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0031 0.3812 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Onchocerca volvulus 0.002 0.1685 1
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Entamoeba histolytica hypothetical protein 0.0038 0.5061 1
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.7494 0.7494
Echinococcus granulosus glycine receptor subunit beta 0.002 0.1685 0.1685
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0027 0.312 0.1907
Loa Loa (eye worm) isocitrate dehydrogenase 0.0031 0.3812 0.3812
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.002 0.1685 0.1685
Loa Loa (eye worm) TAR-binding protein 0.0064 1 1
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) ACC-1 protein 0.002 0.1685 0.1685
Onchocerca volvulus Putative nachr subunit 0.002 0.1685 1
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Echinococcus multilocularis isocitrate dehydrogenase 0.0031 0.3812 0.3812
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Brugia malayi hypothetical protein 0.0026 0.2956 0.2956
Toxoplasma gondii isocitrate dehydrogenase 0.0031 0.3812 1
Schistosoma mansoni tar DNA-binding protein 0.0064 1 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0031 0.3812 0.3812
Echinococcus multilocularis tar DNA binding protein 0.0064 1 1
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Brugia malayi RNA recognition motif domain containing protein 0.0064 1 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Brugia malayi Isocitrate dehydrogenase 0.0031 0.3812 0.3812
Loa Loa (eye worm) LGC-31 protein 0.002 0.1685 0.1685
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.002 0.1685 0.1685
Loa Loa (eye worm) flap endonuclease-1 0.0027 0.312 0.312
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.002 0.1685 0.1685
Schistosoma mansoni hypothetical protein 0.0016 0.1025 0.1025
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Echinococcus multilocularis glycine receptor subunit beta 0.002 0.1685 0.1685
Brugia malayi Cation transporter family protein 0.002 0.1685 0.1685
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.002 0.1685 0.1685
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.002 0.1685 0.1685
Echinococcus multilocularis glycine receptor subunit beta 0.002 0.1685 0.1685
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.1025 0.1025
Brugia malayi excitatory GABA receptor EXP-1A 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.0026 0.2956 0.2956
Schistosoma mansoni hypothetical protein 0.0016 0.1025 0.1025
Loa Loa (eye worm) ACC-1 protein 0.002 0.1685 0.1685
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.002 0.1685 0.1685
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0031 0.3812 0.5
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0031 0.3812 0.3812
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.002 0.1685 0.1685
Onchocerca volvulus 0.002 0.1685 1
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.002 0.1685 0.1685
Entamoeba histolytica Flap nuclease, putative 0.0027 0.312 0.6164
Echinococcus multilocularis GPCR, family 2 0.0016 0.1025 0.1025
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0027 0.312 0.1907
Entamoeba histolytica hypothetical protein 0.0038 0.5061 1
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Brugia malayi hypothetical protein 0.0038 0.5061 0.5061
Echinococcus multilocularis nAChR subunit 0.002 0.1685 0.1685
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 1 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.45 0.45
Echinococcus granulosus glycine receptor subunit beta 0.002 0.1685 0.1685
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.7494 0.7494
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.1685 0.1685
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.002 0.1685 0.1685
Schistosoma mansoni tar DNA-binding protein 0.0064 1 1
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0027 0.312 0.1907
Plasmodium falciparum flap endonuclease 1 0.0027 0.312 0.1907
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.0016 0.1025 0.1025
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.002 0.1685 0.1685
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.002 0.1685 0.1685
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0031 0.3812 1
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Schistosoma mansoni tar DNA-binding protein 0.0064 1 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0031 0.3812 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0031 0.3812 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Schistosoma mansoni tar DNA-binding protein 0.0064 1 1
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.5061 0.5061
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0031 0.3812 0.3812
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.002 0.1685 0.1685
Onchocerca volvulus 0.002 0.1685 1
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.002 0.1685 0.1685
Trichomonas vaginalis flap endonuclease-1, putative 0.0027 0.312 0.5
Onchocerca volvulus 0.002 0.1685 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0026 0.2974 0.2974
Onchocerca volvulus 0.002 0.1685 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0031 0.3812 0.3812
Echinococcus granulosus nAChR subunit 0.002 0.1685 0.1685
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.002 0.1685 0.1685
Brugia malayi Cation transporter family protein 0.002 0.1685 0.1685
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0031 0.3812 1
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0241 0.0241
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.1025 0.1025
Schistosoma mansoni hypothetical protein 0.0012 0.0241 0.0241
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.1025 0.1025
Loa Loa (eye worm) hypothetical protein 0.0051 0.7494 0.7494
Plasmodium vivax flap endonuclease 1, putative 0.0027 0.312 0.1907
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Brugia malayi Latrophilin receptor protein 2 0.0016 0.1025 0.1025
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.1025 0.1025
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Schistosoma mansoni hypothetical protein 0.0016 0.1025 0.1025
Brugia malayi TAR-binding protein 0.0064 1 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.1685 0.1685
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.002 0.1685 0.1685
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0241 0.0241
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Schistosoma mansoni hypothetical protein 0.0035 0.45 0.45
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.1685 0.1685
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.1025 0.1025
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0031 0.3812 0.3812
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.002 0.1685 0.1685
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.1025 0.1025
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.002 0.1685 0.1685
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.002 0.1685 0.1685
Brugia malayi Cation transporter family protein 0.002 0.1685 0.1685
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.002 0.1685 0.1685
Brugia malayi Cytochrome P450 family protein 0.0026 0.2974 0.2974
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.002 0.1685 0.1685
Brugia malayi Flap endonuclease-1 0.0027 0.312 0.312
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.1685 0.1685
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0031 0.3812 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Toxoplasma gondii isocitrate dehydrogenase 0.0031 0.3812 1
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.002 0.1685 0.1685
Entamoeba histolytica hypothetical protein 0.0038 0.5061 1
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.002 0.1685 0.1685
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0031 0.3812 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.1685 0.1685
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.1685 0.1685
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.002 0.1685 0.1685
Loa Loa (eye worm) hypothetical protein 0.002 0.1685 0.1685
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.1685 0.1685
Echinococcus granulosus tar DNA binding protein 0.0064 1 1
Schistosoma mansoni nAChR subunit 0.002 0.1685 0.1685
Schistosoma mansoni hypothetical protein 0.0038 0.5061 0.5061
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0031 0.3812 0.3812

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

Bibliographic References

No literature references available for this target.

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