Detailed information for compound 1354284

Basic information

Technical information
  • TDR Targets ID: 1354284
  • Name: 4-acetyl-N-[2-(1H-indol-3-yl)ethyl]-3,5-dimet hyl-1H-pyrrole-2-carboxamide
  • MW: 323.389 | Formula: C19H21N3O2
  • H donors: 3 H acceptors: 2 LogP: 2.85 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1[nH]c(c(c1C)C(=O)C)C)NCCc1c[nH]c2c1cccc2
  • InChi: 1S/C19H21N3O2/c1-11-17(13(3)23)12(2)22-18(11)19(24)20-9-8-14-10-21-16-7-5-4-6-15(14)16/h4-7,10,21-22H,8-9H2,1-3H3,(H,20,24)
  • InChiKey: VUWJIMWJHAMLQA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-ethanoyl-N-[2-(1H-indol-3-yl)ethyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
  • ZINC07063799
  • T5425387

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens Niemann-Pick disease, type C1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128206 All targets in OG5_128206
Schistosoma japonicum Niemann-Pick C1 protein precursor, putative Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus multilocularis expressed conserved protein Get druggable targets OG5_128206 All targets in OG5_128206
Candida albicans potential membrane protein similar to S. cerevisiae NCR1 (YPL006W) and human NPC1 late endosomal protein involved in sterol home Get druggable targets OG5_128206 All targets in OG5_128206
Brugia malayi Niemann-Pick C1 protein precursor Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus multilocularis Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus granulosus Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus multilocularis Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Schistosoma japonicum Niemann-Pick C1 protein precursor, putative Get druggable targets OG5_128206 All targets in OG5_128206
Entamoeba histolytica Niemann-Pick C1 protein, putative Get druggable targets OG5_128206 All targets in OG5_128206
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus granulosus Niemann Pick C1 protein Get druggable targets OG5_128206 All targets in OG5_128206
Schistosoma japonicum ko:K07003 Niemann Pick type C1, putative Get druggable targets OG5_128206 All targets in OG5_128206
Schistosoma mansoni niemann-pick C1 (NPC1) Get druggable targets OG5_128206 All targets in OG5_128206
Echinococcus granulosus expressed conserved protein Get druggable targets OG5_128206 All targets in OG5_128206
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.0015 0.0177 0.0716
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Leishmania major glucose transporter, lmgt2 0.0034 0.0583 0.8107
Schistosoma mansoni glucose transport protein 0.0108 0.2234 0.881
Onchocerca volvulus 0.0015 0.0177 1
Echinococcus granulosus calcium dependent protein kinase 0.0031 0.0528 0.1026
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0246 0.1383
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Brugia malayi Sugar transporter family protein 0.0108 0.2234 0.904
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0583 0.8107
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0024 0.0375 0.3046
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0583 0.1973
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0033 0.0573 0.232
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0033 0.0573 0.1158
Echinococcus multilocularis General substrate transporter 0.0093 0.1898 0.5026
Entamoeba histolytica hypothetical protein 0.0043 0.0802 0.2037
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0032 0.0559 0.1855
Echinococcus multilocularis protein dispatched 1 0.0058 0.1129 0.2781
Schistosoma mansoni protein kinase 0.0033 0.0573 0.1698
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0678 1
Schistosoma mansoni serine/threonine protein kinase 0.0033 0.0573 0.1698
Loa Loa (eye worm) sugar transporter 0.0108 0.2234 0.904
Plasmodium falciparum calcium-dependent protein kinase 1 0.0033 0.0574 0.0574
Plasmodium vivax calcium-dependent protein kinase, putative 0.0033 0.0574 0.0574
Loa Loa (eye worm) hypothetical protein 0.0033 0.0573 0.232
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Onchocerca volvulus 0.0015 0.0177 1
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Echinococcus multilocularis Niemann Pick C1 protein 0.017 0.36 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0051 0.0969 0.3923
Toxoplasma gondii facilitative glucose transporter GT1 0.0108 0.2234 0.3383
Plasmodium falciparum lysine--tRNA ligase 0.0024 0.0375 0.0375
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Plasmodium falciparum mitogen-activated protein kinase 2 0.0175 0.3708 0.3708
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.2234 1
Toxoplasma gondii lysine-tRNA ligase 0.0024 0.0375 0.0568
Schistosoma mansoni hypothetical protein 0.0049 0.0929 0.3219
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0033 0.0573 0.7919
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0583 0.1973
Schistosoma mansoni hypothetical protein 0.0049 0.0929 0.3219
Schistosoma mansoni patched 1 0.0051 0.0969 0.3394
Brugia malayi Sugar transporter family protein 0.0015 0.0177 0.0716
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0033 0.0574 0.0574
Entamoeba histolytica protein kinase, putative 0.0033 0.0573 0.0948
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0559 0.1634
Onchocerca volvulus 0.0015 0.0177 1
Onchocerca volvulus 0.0015 0.0177 1
Trypanosoma brucei glucose transporter 2A 0.0034 0.0583 0.8107
Onchocerca volvulus 0.0015 0.0177 1
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0032 0.0559 1
Echinococcus granulosus expressed conserved protein 0.0112 0.2312 0.6236
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0032 0.0559 0.226
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0583 0.1973
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0678 1
Plasmodium vivax lysine--tRNA ligase, putative 0.0024 0.0375 0.0375
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Echinococcus multilocularis Niemann Pick C1 protein 0.0119 0.2471 0.6702
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0583 0.1973
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0678 1
Toxoplasma gondii protein kinase, putative 0.0306 0.6604 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0375 0.1516
Loa Loa (eye worm) sugar transporter 0.0015 0.0177 0.0716
Echinococcus granulosus sterol regulatory element binding protein 0.0051 0.0969 0.2315
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0583 0.8107
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Plasmodium falciparum calcium-dependent protein kinase 4 0.0033 0.0574 0.0574
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0375 0.0847
Loa Loa (eye worm) hypothetical protein 0.0026 0.0424 0.1715
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Chlamydia trachomatis lysine--tRNA ligase 0.0024 0.0375 1
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0375 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.1223 0.4951
Brugia malayi hypothetical protein 0.0015 0.0177 0.0716
Echinococcus granulosus Niemann Pick C1 protein 0.0119 0.2471 0.6702
Echinococcus granulosus Protein patched homolog 1 0.0051 0.0969 0.2315
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0038 0.0678 0.1026
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0015 0.0177 0.0177
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0121 0.2512 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Toxoplasma gondii sugar transporter ST1 0.0015 0.0177 0.0268
Toxoplasma gondii transporter, major facilitator family protein 0.0015 0.0177 0.0268
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0583 0.8107
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0175 0.3708 0.5616
Onchocerca volvulus Putative transporter 0.0015 0.0177 1
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0802 0.2676
Loa Loa (eye worm) hypothetical protein 0.0051 0.0969 0.3923
Echinococcus granulosus Niemann Pick C1 protein 0.017 0.36 1
Plasmodium falciparum protein kinase 7 0.0306 0.6604 0.6604
Echinococcus multilocularis sterol regulatory element binding protein 0.0051 0.0969 0.2315
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0177 0.0716
Echinococcus multilocularis lysyl tRNA synthetase 0.0024 0.0375 0.0578
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0177 0.0716
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0119 0.2471 1
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0678 1
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0375 0.0847
Onchocerca volvulus 0.0015 0.0177 1
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0033 0.0574 0.0869
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0559 0.1634
Schistosoma mansoni glucose transport protein 0.0108 0.2234 0.881
Treponema pallidum prolyl-tRNA synthetase 0.0011 0.0094 0.5
Plasmodium falciparum calcium-dependent protein kinase 2 0.0033 0.0574 0.0574
Brugia malayi major facilitator superfamily protein 0.0015 0.0177 0.0716
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0177 0.0716
Leishmania major lysyl-tRNA synthetase, putative 0.0024 0.0375 0.395
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0024 0.0375 0.395
Plasmodium vivax proline--tRNA ligase, putative 0.0038 0.0678 0.0678
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0177 0.0716
Onchocerca volvulus 0.0015 0.0177 1
Schistosoma mansoni protein kinase 0.0033 0.0573 0.1698
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0583 0.1973
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0033 0.0574 0.0574
Trypanosoma brucei glucose transporter 1E 0.0034 0.0583 0.8107
Schistosoma mansoni glucose transport protein 0.0108 0.2234 0.881
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0583 0.1973
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.0375 0.0961
Brugia malayi lysyl-tRNA synthetase 0.0024 0.0375 0.1516
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0032 0.0559 0.0877
Plasmodium falciparum proline--tRNA ligase 0.0038 0.0678 0.0678
Onchocerca volvulus 0.0015 0.0177 1
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0033 0.0574 0.0574
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Echinococcus multilocularis protein patched 0.0051 0.0969 0.2315
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Brugia malayi hypothetical protein 0.0043 0.0802 0.3245
Brugia malayi major facilitator superfamily protein 0.0015 0.0177 0.0716
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0375 1
Schistosoma mansoni hypothetical protein 0.0049 0.0929 0.3219
Schistosoma mansoni hypothetical protein 0.0049 0.0929 0.3219
Onchocerca volvulus 0.0015 0.0177 1
Trichomonas vaginalis CAMK family protein kinase 0.0033 0.0573 0.1927
Giardia lamblia Prolyl-tRNA synthetase 0.0032 0.0559 1
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0108 0.2234 0.6009
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0033 0.0574 0.0869
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0032 0.0559 0.1115
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0583 0.8107
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Schistosoma mansoni hypothetical protein 0.0108 0.2234 0.881
Loa Loa (eye worm) hypothetical protein 0.0032 0.0559 0.226
Entamoeba histolytica protein kinase, putative 0.0033 0.0573 0.0948
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0013 0.0135 0.0547
Onchocerca volvulus 0.0015 0.0177 1
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0583 0.1973
Onchocerca volvulus 0.0015 0.0177 1
Onchocerca volvulus 0.0015 0.0177 1
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0032 0.0559 0.1115
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0033 0.0574 0.0869
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0583 0.8107
Trypanosoma cruzi hexose transporter 0.0034 0.0583 0.8107
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Onchocerca volvulus 0.0015 0.0177 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Leishmania major glucose transporter, lmgt3 0.0034 0.0583 0.8107
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0573 0.1158
Mycobacterium ulcerans integral membrane transport protein 0.0015 0.0177 0.2954
Loa Loa (eye worm) hypothetical protein 0.0032 0.0559 0.226
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0024 0.0375 0.395
Echinococcus multilocularis expressed conserved protein 0.0112 0.2312 0.6236
Leishmania major glucose transporter/membrane transporter D2, putative 0.0034 0.0583 0.8107
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0021 0.0294 1
Onchocerca volvulus 0.0015 0.0177 1
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0021 0.0309 0.0641
Plasmodium falciparum hexose transporter 0.0108 0.2234 0.2234
Entamoeba histolytica hypothetical protein 0.0043 0.0802 0.2037
Brugia malayi CHE-14 protein 0.0051 0.0969 0.3923
Leishmania major glucose transporter, lmgt1 0.0034 0.0583 0.8107
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Plasmodium falciparum calcium-dependent protein kinase 3 0.0033 0.0574 0.0574
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0583 0.8107
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0802 0.1825
Onchocerca volvulus 0.0015 0.0177 1
Entamoeba histolytica hypothetical protein 0.0043 0.0802 0.2037
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0021 0.0294 1
Echinococcus multilocularis calcium dependent protein kinase 0.0031 0.0528 0.1026
Schistosoma mansoni hypothetical protein 0.0043 0.0802 0.2676
Brugia malayi hypothetical protein 0.0015 0.0177 0.0716
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0175 0.3708 0.3708
Onchocerca volvulus 0.0015 0.0177 1
Toxoplasma gondii sugar transporter ST3 0.0015 0.0177 0.0268
Giardia lamblia Lysyl-tRNA synthetase 0.0024 0.0375 0.5182
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0032 0.0559 0.226
Echinococcus granulosus lysyl tRNA synthetase 0.0024 0.0375 0.0578
Brugia malayi Sugar transporter family protein 0.0015 0.0177 0.0716
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0802 0.1825
Schistosoma mansoni protein kinase 0.0033 0.0573 0.1698
Plasmodium falciparum calcium-dependent protein kinase 5 0.0033 0.0574 0.0574
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0033 0.0573 0.232
Brugia malayi Cam kinase protein 1 0.0033 0.0573 0.232
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0015 0.0177 0.2954
Echinococcus granulosus General substrate transporter 0.0093 0.1898 0.5026
Plasmodium vivax sugar transporter, putative 0.0015 0.0177 0.0177
Loa Loa (eye worm) hypothetical protein 0.0119 0.2471 1
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0969 0.3852
Leishmania major protein kinase, putative 0.0033 0.0573 0.7919
Toxoplasma gondii sugar transporter ST2 0.0015 0.0177 0.0268
Mycobacterium ulcerans sugar transporter 0.0015 0.0177 0.2954
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0177 0.0716
Plasmodium vivax hexose transporter 0.0108 0.2234 0.2234
Entamoeba histolytica hypothetical protein 0.0043 0.0802 0.2037
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0015 0.0177 0.5
Plasmodium vivax CDK-related protein kinase 6, putative 0.0459 1 1
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0033 0.0573 0.232
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2234 0.6009
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0015 0.0177 0.2954
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Trypanosoma brucei glucose transporter, putative 0.0034 0.0583 0.8107
Loa Loa (eye worm) hypothetical protein 0.0015 0.0177 0.0716
Brugia malayi Niemann-Pick C1 protein precursor 0.0119 0.2471 1
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0678 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for NPC1 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10.3225 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 25.9185 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 25.9185 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
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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