Detailed information for compound 517889

Basic information

Technical information
  • TDR Targets ID: 517889
  • Name: (E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-yl pent-2-en-1-one
  • MW: 287.354 | Formula: C17H21NO3
  • H donors: 0 H acceptors: 1 LogP: 3.06 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCCCC1)/C=C/CCc1ccc2c(c1)OCO2
  • InChi: 1S/C17H21NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h3,7-9,12H,1-2,4-6,10-11,13H2/b7-3+
  • InChiKey: QHWOFMXDKFORMO-XVNBXDOJSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (E)-5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)pent-2-en-1-one
  • (E)-5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)-2-penten-1-one
  • (E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-yl-pent-2-en-1-one
  • (E)-5-(1,3-benzodioxol-5-yl)-1-piperidino-pent-2-en-1-one
  • 5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpent-2-en-1-one
  • 5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)pent-2-en-1-one
  • 5-(1,3-benzodioxol-5-yl)-1-piperidino-pent-2-en-1-one
  • 5-(1,3-benzodioxol-5-yl)-1-piperidin-1-yl-pent-2-en-1-one
  • 65937-41-9
  • MEGxp0_000204
  • NSC125180
  • Piperanine
  • ACon1_000146

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens transient receptor potential cation channel, subfamily V, member 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
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
Echinococcus multilocularis cell adhesion molecule:down regulated by 0.0015 0.0132 0.0101
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0056 0.267 1
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0068 0.3409 0.8675
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0056 0.267 0.7545
Loa Loa (eye worm) hypothetical protein 0.0018 0.0295 0.075
Loa Loa (eye worm) LAD-2 short isoform 0.0015 0.0132 0.0336
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0123 0.0312
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0015 0.0132 0.0101
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Brugia malayi Immunoglobulin I-set domain containing protein 0.0069 0.3465 0.8781
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0015 0.0132 0.0336
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Schistosoma mansoni hypothetical protein 0.0175 1 1
Echinococcus multilocularis tyrosine protein kinase otk 0.0015 0.0132 0.0101
Echinococcus granulosus contactin 0.0015 0.0132 0.0101
Loa Loa (eye worm) TAR-binding protein 0.0076 0.3929 1
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0401 0.073
Echinococcus granulosus Immunoglobulin subtype 0.0015 0.0132 0.0101
Echinococcus multilocularis geminin 0.0175 1 1
Onchocerca volvulus 0.0028 0.0921 1
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0068 0.3409 1
Schistosoma mansoni hypothetical protein 0.0175 1 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.3929 0.3848
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus multilocularis roundabout 2 0.0015 0.0132 0.0101
Brugia malayi Heparan sulfate 0.0015 0.0132 0.0025
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0068 0.3409 0.332
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0015 0.0132 0.0101
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus granulosus mitogen activated protein kinase 0.0056 0.267 0.2647
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Loa Loa (eye worm) hypothetical protein 0.0027 0.0889 0.2263
Echinococcus multilocularis conserved hypothetical protein 0.0054 0.2535 0.2511
Echinococcus multilocularis Immunoglobulin 0.0015 0.0132 0.0101
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0401 0.5
Loa Loa (eye worm) immunoglobulin domain-containing protein 0.0015 0.0132 0.0336
Schistosoma mansoni ap endonuclease 0.0019 0.0401 0.0272
Echinococcus granulosus netrin receptor unc 5 0.0015 0.0132 0.0101
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0015 0.0132 0.0101
Brugia malayi Immunoglobulin I-set domain containing protein 0.0069 0.3465 0.8781
Echinococcus multilocularis Immunoglobulin 0.0015 0.0132 0.0101
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0401 0.5
Echinococcus multilocularis mitogen activated protein kinase 3 0.0056 0.267 0.2647
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus multilocularis Immunoglobulin 0.0054 0.2535 0.2511
Loa Loa (eye worm) hypothetical protein 0.0013 0.0031 0.008
Brugia malayi basement membrane proteoglycan 0.0015 0.0132 0.0025
Schistosoma mansoni serine/threonine protein kinase 0.0056 0.267 0.2572
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0056 0.267 0.6796
Schistosoma mansoni hypothetical protein 0.0054 0.2535 0.2435
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0401 0.5
Echinococcus granulosus transcription factor Dp 1 0.0039 0.1637 0.1611
Schistosoma mansoni lamin 0.0028 0.0921 0.0799
Echinococcus multilocularis neuroglian 0.0015 0.0132 0.0101
Echinococcus granulosus 3'partial|cell adhesion molecule:down regulated by 0.0015 0.0132 0.0101
Echinococcus granulosus roundabout 2 0.0015 0.0132 0.0101
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0056 0.267 0.7545
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0921 0.2343
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus multilocularis leucine rich repeat containing protein 4 0.0015 0.0132 0.0101
Echinococcus granulosus mitogen activated protein kinase 3 0.0056 0.267 0.2647
Echinococcus multilocularis lamin 0.0028 0.0921 0.0892
Echinococcus multilocularis peroxidasin 0.0015 0.0132 0.0101
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0068 0.3409 0.3388
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.3409 1
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0015 0.0132 0.0101
Echinococcus granulosus intermediate filament protein 0.0028 0.0921 0.0892
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus multilocularis pro neuregulin 2, membrane bound 0.0015 0.0132 0.0101
Trichomonas vaginalis CMGC family protein kinase 0.0056 0.267 1
Echinococcus multilocularis irregular chiasm roughest protein immunoglobulin set domain containing protein 0.0054 0.2535 0.2511
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0015 0.0132 0.0336
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus multilocularis hemicentin 1 0.0015 0.0132 0.0101
Schistosoma mansoni hypothetical protein 0.0054 0.2535 0.2435
Schistosoma mansoni tar DNA-binding protein 0.0076 0.3929 0.3848
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0401 0.037
Giardia lamblia Kinase, CMGC MAPK 0.0056 0.267 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0159 0.0403
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0068 0.3409 0.3388
Echinococcus granulosus lamin 0.0028 0.0921 0.0892
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0921 0.2096
Echinococcus granulosus low density lipoprotein receptor ldl 0.0015 0.0132 0.0101
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0401 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0015 0.0132 0.0336
Echinococcus multilocularis low density lipoprotein receptor (ldl) 0.0015 0.0132 0.0101
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0069 0.3465 0.8819
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0056 0.267 0.7545
Echinococcus granulosus hemicentin 1 0.0015 0.0132 0.0101
Echinococcus granulosus nephrin 0.0054 0.2535 0.2511
Brugia malayi Immunoglobulin domain containing protein 0.0015 0.0132 0.0025
Schistosoma mansoni tar DNA-binding protein 0.0076 0.3929 0.3848
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Schistosoma mansoni tar DNA-binding protein 0.0076 0.3929 0.3848
Echinococcus multilocularis Immunoglobulin subtype 0.0015 0.0132 0.0101
Echinococcus multilocularis tar DNA binding protein 0.0076 0.3929 0.391
Brugia malayi Prion-like- 0.0015 0.0132 0.0025
Echinococcus granulosus roundabout 2 0.0015 0.0132 0.0101
Echinococcus multilocularis nephrin 0.0054 0.2535 0.2511
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus granulosus Immunoglobulin 0.0015 0.0132 0.0101
Brugia malayi RNA binding protein 0.0076 0.3929 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0015 0.0132 0.0101
Echinococcus granulosus tyrosine protein kinase otk 0.0015 0.0132 0.0101
Echinococcus multilocularis transcription factor Dp 1 0.0039 0.1637 0.1611
Trichomonas vaginalis CMGC family protein kinase 0.0056 0.267 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0068 0.3409 0.8632
Echinococcus granulosus nephrin 0.0054 0.2535 0.2511
Schistosoma mansoni tar DNA-binding protein 0.0076 0.3929 0.3848
Schistosoma mansoni lamin 0.0028 0.0921 0.0799
Brugia malayi Peroxidasin 0.0015 0.0132 0.0025
Echinococcus granulosus pro neuregulin 2 membrane bound 0.0015 0.0132 0.0101
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.3409 1
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0016 0.0164 0.0416
Loa Loa (eye worm) hypothetical protein 0.0028 0.0921 0.2343
Trypanosoma brucei protein kinase, putative 0.0056 0.267 0.7545
Echinococcus multilocularis lamin dm0 0.0028 0.0921 0.0892
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0056 0.267 0.7545
Echinococcus multilocularis roundabout 2 0.0015 0.0132 0.0101
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0921 0.2343
Echinococcus granulosus lachesin 0.0015 0.0132 0.0101
Echinococcus granulosus lamin dm0 0.0028 0.0921 0.0892
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Brugia malayi hypothetical protein 0.0069 0.3465 0.8781
Echinococcus multilocularis mitogen activated protein kinase 0.0056 0.267 0.2647
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0015 0.0132 0.0101
Brugia malayi Immunoglobulin domain containing protein 0.0015 0.0132 0.0025
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Loa Loa (eye worm) RNA binding protein 0.0076 0.3929 1
Echinococcus multilocularis lachesin 0.0015 0.0132 0.0101
Echinococcus multilocularis musashi 0.0028 0.0921 0.0892
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0015 0.0132 0.0101
Brugia malayi intermediate filament protein 0.0028 0.0921 0.2096
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0015 0.0132 0.0101
Schistosoma mansoni intermediate filament proteins 0.0028 0.0921 0.0799
Brugia malayi basement membrane proteoglycan precursor 0.0015 0.0132 0.0025
Echinococcus multilocularis netrin receptor unc 5 0.0015 0.0132 0.0101
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus granulosus tar DNA binding protein 0.0076 0.3929 0.391
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0401 0.5
Brugia malayi Immunoglobulin domain containing protein 0.0015 0.0132 0.0025
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0069 0.3465 0.8819
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0401 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus granulosus roundabout 2 0.0015 0.0132 0.0101
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0056 0.267 0.7545
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0401 0.037
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0401 0.1019
Loa Loa (eye worm) hypothetical protein 0.0015 0.0132 0.0336
Echinococcus granulosus irregular chiasm roughest protein 0.0054 0.2535 0.2511
Brugia malayi GCC2 and GCC3 family protein 0.0018 0.0295 0.0451
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0056 0.267 0.7545
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0015 0.0132 0.0101
Onchocerca volvulus 0.0028 0.0921 1
Trichomonas vaginalis CMGC family protein kinase 0.0056 0.267 1
Trichomonas vaginalis CMGC family protein kinase 0.0056 0.267 1
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.3929 1
Echinococcus granulosus basement membrane specific heparan sulfate 0.0015 0.0132 0.0101
Echinococcus granulosus peroxidasin 0.0015 0.0132 0.0101
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.3929 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.3409 1
Echinococcus granulosus Immunoglobulin 0.0015 0.0132 0.0101
Echinococcus granulosus Immunoglobulin 0.0054 0.2535 0.2511
Echinococcus multilocularis roundabout 2 0.0015 0.0132 0.0101
Echinococcus granulosus neuroglian 0.0015 0.0132 0.0101
Schistosoma mansoni ap endonuclease 0.0019 0.0401 0.0272
Brugia malayi TAR-binding protein 0.0076 0.3929 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0068 0.3409 1
Echinococcus multilocularis hemicentin 1 0.0015 0.0132 0.0101
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0056 0.267 0.7545
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0132 0.0025
Brugia malayi MAP kinase sur-1 0.0056 0.267 0.6693
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0015 0.0132 0.0101

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 8.3 % Antidiabetic activity in mouse 3T3L1 cells assessed as enhancement of triglyceride accumulation at 30 uM ChEMBL. 18477507
Activity (functional) = 13.1 % Antidiabetic activity in mouse 3T3L1 cells assessed as enhancement of triglyceride accumulation at 10 uM ChEMBL. 18477507
Activity (functional) = 19.1 % Antidiabetic activity in mouse 3T3L1 cells assessed as enhancement of triglyceride accumulation at 3 uM ChEMBL. 18477507
Activity (functional) = 20.4 % Antidiabetic activity in mouse 3T3L1 cells assessed as enhancement of triglyceride accumulation at 1 uM ChEMBL. 18477507
EC50 (functional) = 5.4 Agonist activity at human TRPV1 expressed in tetracycline-stimulated HEK293 cells assessed as increase in intracellular calcium levels by fluorimetric assay ChEMBL. 20381363
Emax (functional) = 88 % Agonist activity at human TRPV1 expressed in tetracycline-stimulated HEK293 cells assessed as increase in intracellular calcium levels by fluorimetric assay relative to control ChEMBL. 20381363
IC50 (functional) Antitrypanosomal activity against epimastigote forms of Trypanosoma cruzi Y after 72 hr ChEMBL. No reference
IC50 (functional) = 17 uM Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine/TNFalpha-induced cytotoxicity after 20 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = -1 % Cytoprotective activity in mouse L929 cells assessed as inhibition of TNF-alpha-induced cytotoxicity at 100 uM by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 2 % Cytoprotective activity in mouse L929 cells assessed as inhibition of TNF-alpha-induced cytotoxicity at 30 uM by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 5 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine-induced cytotoxicity at 3 uM after 44 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 11 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine-induced cytotoxicity at 100 uM after 44 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 11 % Cytoprotective activity in mouse L929 cells assessed as inhibition of TNF-alpha-induced cytotoxicity at 10 uM by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 12 % Cytoprotective activity in mouse L929 cells assessed as inhibition of TNF-alpha-induced cytotoxicity at 3 uM by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 14 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine-induced cytotoxicity at 10 uM after 44 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 14 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine-induced cytotoxicity at 30 uM after 44 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 31 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 3 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 31 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 3 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 31 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine/TNFalpha-induced cytotoxicity at 3 uM after 20 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 50 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 10 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 50 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 10 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 50 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine/TNFalpha-induced cytotoxicity at 10 uM after 20 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Inhibition (functional) = 53 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 30 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 53 % Inhibition of D-galactosamine/TNFalpha-induced cell death in ddY mouse hepatocytes at 30 uM after 20 hrs by MTT assay ChEMBL. 18289853
Inhibition (functional) = 53 % Hepatoprotective activity in ddY mouse hepatocytes assessed as inhibition of D-galactosamine/TNFalpha-induced cytotoxicity at 30 uM after 20 hrs by MTT assay relative to untreated control ChEMBL. 19775895
Potency (functional) 3.5481 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5878 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

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Mus musculus ChEMBL23 19775895

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

2 literature references were collected for this gene.

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