Detailed information for compound 1441658

Basic information

Technical information
  • TDR Targets ID: 1441658
  • Name: 2-(2-fluorophenyl)-N-(2-pyrrolidin-1-ylphenyl )acetamide
  • MW: 298.355 | Formula: C18H19FN2O
  • H donors: 1 H acceptors: 1 LogP: 3.4 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Cc1ccccc1F)Nc1ccccc1N1CCCC1
  • InChi: 1S/C18H19FN2O/c19-15-8-2-1-7-14(15)13-18(22)20-16-9-3-4-10-17(16)21-11-5-6-12-21/h1-4,7-10H,5-6,11-13H2,(H,20,22)
  • InChiKey: WNZBKSSIQSMONM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(2-fluorophenyl)-N-(2-1-pyrrolidinylphenyl)acetamide
  • 2-(2-fluorophenyl)-N-(2-pyrrolidin-1-ylphenyl)ethanamide
  • ZINC05089930

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major beta tubulin 0.0364 1 1
Leishmania major beta tubulin 0.0364 1 1
Loa Loa (eye worm) hypothetical protein 0.006 0.1539 0.1401
Leishmania major beta tubulin 0.0364 1 1
Loa Loa (eye worm) tubulin beta-4 chain 0.0364 1 1
Schistosoma mansoni alpha tubulin 0.0142 0.3805 0.3805
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.1539 0.1401
Brugia malayi beta-tubulin, identical 0.0364 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Giardia lamblia Beta tubulin 0.0364 1 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0392 0.0294
Trypanosoma brucei alpha tubulin, putative 0.008 0.2093 0.0616
Echinococcus multilocularis tubulin delta chain 0.0061 0.1574 0.1487
Brugia malayi Cell division protein ftsZ 0.0061 0.1574 0.144
Leishmania major beta tubulin 0.0364 1 1
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Plasmodium vivax tubulin beta chain, putative 0.0364 1 1
Echinococcus granulosus peroxisome assembly protein 26 0.0142 0.3805 0.3742
Echinococcus granulosus Tubulin beta 2C chain 0.0364 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0364 1 1
Plasmodium vivax tubulin gamma chain, putative 0.0142 0.3805 0.2648
Brugia malayi tubulin alpha chain - mouse 0.0142 0.3805 0.3707
Trypanosoma cruzi tubulin gamma chain 0.0142 0.3805 0.2648
Mycobacterium ulcerans cell division protein FtsZ 0.0061 0.1574 0.5
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.016 0.006
Trypanosoma brucei alpha tubulin 0.0142 0.3805 0.2648
Echinococcus multilocularis Tubulin beta 2C chain 0.0364 1 1
Mycobacterium tuberculosis Cell division protein FtsZ 0.0061 0.1574 0.5
Leishmania major beta tubulin 0.0364 1 1
Echinococcus granulosus tubulin beta 1 chain 0.0364 1 1
Brugia malayi Tubulin beta chain 0.008 0.2093 0.1967
Trichomonas vaginalis tubulin, putative 0.008 0.2093 0.2029
Schistosoma mansoni hypothetical protein 0.0205 0.5564 0.5564
Leishmania major beta tubulin 0.0364 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0364 1 1
Echinococcus granulosus tubulin delta chain 0.0061 0.1574 0.1487
Echinococcus multilocularis tubulin alpha 1C chain 0.0142 0.3805 0.3742
Loa Loa (eye worm) tubulin beta chain 0.0061 0.1574 0.1436
Echinococcus multilocularis tubulin subunit TubB 0.0142 0.3805 0.3742
Echinococcus granulosus beta tubulin 0.0364 1 1
Treponema pallidum cell division protein FtsZ 0.0061 0.1574 0.5
Echinococcus granulosus Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Schistosoma mansoni cpg binding protein 0.0037 0.0883 0.0883
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Trichomonas vaginalis tubulin epsilon chain, putative 0.0142 0.3805 0.3755
Echinococcus granulosus tubulin beta 4A class IVa 0.0364 1 1
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin beta chain, putative 0.0364 1 1
Echinococcus granulosus tubulin alpha chain 0.0142 0.3805 0.3742
Trypanosoma cruzi epsilon tubulin, putative 0.0142 0.3805 0.2648
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.1539 0.1404
Trypanosoma brucei beta tubulin 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin alpha chain, putative 0.0142 0.3805 0.3755
Echinococcus multilocularis tubulin alpha 0.0142 0.3805 0.3742
Loa Loa (eye worm) alpha-tubulin 0.0142 0.3805 0.3704
Trichomonas vaginalis conserved hypothetical protein 0.0061 0.1574 0.1506
Brugia malayi CXXC zinc finger family protein 0.0035 0.0828 0.0682
Entamoeba histolytica tubulin family protein 0.0364 1 1
Echinococcus granulosus beta tubulin 0.0364 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0364 1 1
Schistosoma mansoni alpha tubulin 0.0142 0.3805 0.3805
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.1539 0.1404
Leishmania major beta tubulin 0.0364 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.008 0.2093 0.2029
Schistosoma mansoni tubulin subunit delta 0.0061 0.1574 0.1574
Leishmania major beta tubulin 0.0364 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0061 0.1574 0.1506
Toxoplasma gondii beta-tubulin, putative 0.0364 1 1
Toxoplasma gondii alpha-tubulin I, putative 0.0142 0.3805 0.2648
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Echinococcus granulosus tubulin alpha 3 chain 0.0142 0.3805 0.3742
Loa Loa (eye worm) tubulin alpha 2 0.008 0.2093 0.1964
Echinococcus granulosus GPCR family 2 0.0019 0.0392 0.0294
Entamoeba histolytica tubulin family protein 0.0364 1 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0392 0.0239
Giardia lamblia Alpha-tubulin 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Echinococcus multilocularis tubulin alpha chain 0.0142 0.3805 0.3742
Brugia malayi Tubulin alpha chain 0.0061 0.1574 0.144
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Leishmania major epsilon tubulin, putative 0.0142 0.3805 0.2648
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0061 0.1574 0.5
Schistosoma mansoni tubulin subunit alpha 0.0142 0.3805 0.3805
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0061 0.1574 0.1506
Schistosoma mansoni hypothetical protein 0.0019 0.0392 0.0392
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.016 0.006
Schistosoma mansoni hypothetical protein 0.0019 0.0392 0.0392
Trichomonas vaginalis tubulin beta chain, putative 0.008 0.2093 0.2029
Onchocerca volvulus 0.008 0.2093 1
Trypanosoma cruzi epsilon tubulin, putative 0.0142 0.3805 0.2648
Loa Loa (eye worm) tubulin alpha-2 chain 0.0142 0.3805 0.3704
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Giardia lamblia Beta tubulin 0.0364 1 1
Trypanosoma brucei beta tubulin 0.0364 1 1
Toxoplasma gondii alpha tubulin TUBA1 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0061 0.1574 0.1506
Loa Loa (eye worm) BEN-1 protein 0.0364 1 1
Plasmodium vivax tubulin alpha chain, putative 0.0142 0.3805 0.2648
Trypanosoma brucei alpha tubulin 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin, putative 0.0061 0.1574 0.1506
Trypanosoma brucei tubulin gamma chain 0.0142 0.3805 0.2648
Leishmania major beta tubulin 0.0364 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0364 1 1
Echinococcus multilocularis cpg binding protein 0.0037 0.0883 0.0789
Echinococcus multilocularis tubulin epsilon chain 0.0142 0.3805 0.3742
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0392 0.0294
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0392 0.0236
Echinococcus granulosus geminin 0.0205 0.5564 0.5518
Trichomonas vaginalis tubulin epsilon chain, putative 0.0142 0.3805 0.3755
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Giardia lamblia Alpha-tubulin 0.0142 0.3805 0.2648
Trypanosoma cruzi alpha tubulin, putative 0.0142 0.3805 0.2648
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.1911 0.1911
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.008 0.2093 0.2029
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0142 0.3805 0.3755
Echinococcus granulosus tubulin alpha chain 0.0142 0.3805 0.3742
Echinococcus multilocularis tubulin alpha 1C chain 0.0142 0.3805 0.3742
Echinococcus granulosus tubulin alpha 1C chain 0.0142 0.3805 0.3742
Loa Loa (eye worm) tubulin gamma chain 0.0142 0.3805 0.3704
Leishmania major beta tubulin 0.0364 1 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.1692 0.0141
Brugia malayi Tubulin beta chain 0.0061 0.1574 0.144
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Loa Loa (eye worm) hypothetical protein 0.0019 0.0392 0.0236
Leishmania major beta tubulin 0.0364 1 1
Echinococcus granulosus tubulin alpha chain 0.0142 0.3805 0.3742
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0392 0.0294
Trichomonas vaginalis tubulin gamma chain, putative 0.0142 0.3805 0.3755
Trypanosoma brucei beta tubulin 0.0364 1 1
Leishmania major beta tubulin 0.0364 1 1
Loa Loa (eye worm) tubulin alpha chain 0.0142 0.3805 0.3704
Echinococcus multilocularis peroxisome assembly protein 26 0.0142 0.3805 0.3742
Loa Loa (eye worm) beta-tubulin 0.0364 1 1
Plasmodium falciparum tubulin gamma chain 0.0142 0.3805 0.2648
Toxoplasma gondii beta-1 tubulin, putative 0.0364 1 1
Echinococcus granulosus tubulin subunit beta 0.0364 1 1
Schistosoma mansoni hypothetical protein 0.0041 0.1008 0.1008
Leishmania major beta tubulin 0.0364 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0061 0.1574 0.1506
Echinococcus multilocularis tubulin alpha 3 chain 0.0142 0.3805 0.3742
Giardia lamblia Beta tubulin 0.0364 1 1
Echinococcus granulosus tubulin alpha 1C chain 0.0142 0.3805 0.3742
Echinococcus multilocularis beta tubulin 0.0364 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.0364 1 1
Plasmodium vivax tubulin epsilon chain, putative 0.0142 0.3805 0.2648
Schistosoma mansoni hypothetical protein 0.0019 0.0392 0.0392
Brugia malayi Tubulin alpha chain 0.0142 0.3805 0.3707
Toxoplasma gondii beta tubulin 0.0364 1 1
Leishmania major beta tubulin 0.0364 1 1
Echinococcus multilocularis GPCR, family 2 0.0019 0.0392 0.0294
Trypanosoma brucei beta tubulin 0.0364 1 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Schistosoma mansoni tubulin subunit alpha 0.0142 0.3805 0.3805
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0392 0.0239
Trichomonas vaginalis tubulin gamma chain, putative 0.0061 0.1574 0.1506
Giardia lamblia Gamma tubulin 0.0142 0.3805 0.2648
Schistosoma mansoni alpha tubulin 0.0142 0.3805 0.3805
Plasmodium falciparum tubulin beta chain 0.0364 1 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0828 0.0678
Echinococcus multilocularis Tubulin beta 2C chain 0.0364 1 1
Plasmodium falciparum alpha tubulin 1 0.0142 0.3805 0.2648
Echinococcus multilocularis tubulin alpha chain 0.0142 0.3805 0.3742
Loa Loa (eye worm) alpha-tubulin 0.0142 0.3805 0.3704
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0364 1 1
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Schistosoma mansoni tubulin subunit beta 0.0061 0.1574 0.1574
Brugia malayi tubulin alpha-2 chain 0.0142 0.3805 0.3707
Echinococcus granulosus alpha tubulin 0.0142 0.3805 0.3742
Echinococcus granulosus tubulin alpha chain 0.0142 0.3805 0.3742
Schistosoma mansoni tubulin subunit beta 0.0364 1 1
Trypanosoma brucei epsilon tubulin 0.0142 0.3805 0.2648
Echinococcus multilocularis tubulin beta 1 chain 0.0364 1 1
Mycobacterium leprae cell division protein FtsZ 0.0061 0.1574 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1008 0.0865
Echinococcus multilocularis tubulin alpha chain 0.0142 0.3805 0.3742
Echinococcus multilocularis Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Echinococcus multilocularis tubulin alpha chain 0.0142 0.3805 0.3742
Leishmania major gamma-tubulin 0.0142 0.3805 0.2648
Trypanosoma brucei beta tubulin 0.0364 1 1
Loa Loa (eye worm) hypothetical protein 0.0142 0.3805 0.3704
Schistosoma mansoni tubulin subunit epsilon 0.0142 0.3805 0.3805
Trichomonas vaginalis tubulin gamma chain, putative 0.0142 0.3805 0.3755
Echinococcus granulosus cpg binding protein 0.0037 0.0883 0.0789
Brugia malayi Tubulin alpha-2 chain 0.0142 0.3805 0.3707
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0392 0.0294
Trichomonas vaginalis tubulin gamma chain, putative 0.0364 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.008 0.2093 0.2029
Loa Loa (eye worm) hypothetical protein 0.0061 0.1574 0.1436
Echinococcus multilocularis Tubulin beta 2C chain 0.0364 1 1
Trypanosoma brucei alpha tubulin 0.0142 0.3805 0.2648
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Echinococcus granulosus tubulin subunit TubB 0.0142 0.3805 0.3742
Schistosoma mansoni cpg binding protein 0.0037 0.0883 0.0883
Echinococcus multilocularis hypothetical protein 0.0142 0.3805 0.3742
Loa Loa (eye worm) tubulin alpha 2 0.008 0.2093 0.1964
Loa Loa (eye worm) hypothetical protein 0.008 0.2093 0.1964
Trichomonas vaginalis tubulin alpha chain, putative 0.008 0.2093 0.2029
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Echinococcus multilocularis tubulin alpha 3 chain 0.0142 0.3805 0.3742
Trichomonas vaginalis tubulin, putative 0.0364 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Echinococcus granulosus Tubulin beta 2C chain 0.0364 1 1
Plasmodium falciparum alpha tubulin 2 0.0142 0.3805 0.2648
Loa Loa (eye worm) BEN-1 protein 0.0364 1 1
Loa Loa (eye worm) tubulin beta-2A chain 0.0364 1 1
Echinococcus granulosus tubulin alpha 0.0142 0.3805 0.3742
Schistosoma mansoni cpg binding protein 0.0035 0.0828 0.0828
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Loa Loa (eye worm) tubulin beta-1 chain 0.0364 1 1
Plasmodium vivax tubulin alpha chain, putative 0.0142 0.3805 0.2648
Brugia malayi alpha-tubulin 0.0142 0.3805 0.3707
Echinococcus granulosus tubulin epsilon chain 0.0142 0.3805 0.3742
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0101 0.0101
Loa Loa (eye worm) alpha-tubulin isotype 2 0.008 0.2093 0.1964
Echinococcus multilocularis tubulin alpha chain 0.0142 0.3805 0.3742
Echinococcus granulosus tubulin gamma 1 chain 0.0142 0.3805 0.3742
Echinococcus granulosus tubulin alpha 3 chain 0.0142 0.3805 0.3742
Schistosoma mansoni tubulin subunit alpha 0.0142 0.3805 0.3805
Echinococcus granulosus tubulin alpha chain 0.0142 0.3805 0.3742
Leishmania major beta tubulin 0.0364 1 1
Trypanosoma brucei epsilon tubulin 0.0142 0.3805 0.2648
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0142 0.3805 0.2648
Echinococcus granulosus Tubulin beta 2C chain 0.0364 1 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.1008 0.0862
Brugia malayi Tubulin alpha-2 chain 0.0142 0.3805 0.3707
Echinococcus multilocularis geminin 0.0205 0.5564 0.5518
Trypanosoma brucei epsilon tubulin 0.0142 0.3805 0.2648
Leishmania major beta tubulin 0.0364 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0364 1 1
Plasmodium falciparum tubulin epsilon chain, putative 0.0142 0.3805 0.2648
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Trypanosoma cruzi beta tubulin, putative 0.0364 1 1
Echinococcus multilocularis tubulin subunit beta 0.0364 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.008 0.2093 0.2029
Loa Loa (eye worm) tubulin alpha chain 0.0142 0.3805 0.3704
Trichomonas vaginalis tubulin, putative 0.008 0.2093 0.2029
Leishmania major beta tubulin 0.0364 1 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.0142 0.3805 0.3742
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Schistosoma mansoni tubulin subunit alpha 0.0061 0.1574 0.1574
Trypanosoma brucei alpha tubulin 0.0142 0.3805 0.2648
Trichomonas vaginalis tubulin beta chain, putative 0.0142 0.3805 0.3755
Leishmania major beta tubulin 0.0364 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.0364 1 1
Echinococcus multilocularis tubulin gamma 1 chain 0.0142 0.3805 0.3742
Schistosoma mansoni hypothetical protein 0.0019 0.0392 0.0392
Echinococcus multilocularis beta tubulin 0.0364 1 1
Loa Loa (eye worm) tubulin alpha-3 chain 0.0061 0.1574 0.1436
Brugia malayi Tubulin gamma chain 0.0142 0.3805 0.3707
Leishmania major alpha tubulin 0.0142 0.3805 0.2648
Schistosoma mansoni hypothetical protein 0.0205 0.5564 0.5564
Schistosoma mansoni tubulin subunit gamma 0.0142 0.3805 0.3805
Loa Loa (eye worm) tubulin beta chain 0.0364 1 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 26.6 % Agonist activity at KCNQ2 expressed in CHO cells at 30 uM incubated for 3 mins by automated patch clamp assay ChEMBL. 22793372
Potency (functional) 0.0058 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference
Potency (functional) 18.526 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) 19.9526 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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

1 literature reference was collected for this gene.

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