Detailed information for compound 1446129

Basic information

Technical information
  • TDR Targets ID: 1446129
  • Name: 4-(1H-indol-3-yl)-N-naphthalen-2-ylbutanamide
  • MW: 328.407 | Formula: C22H20N2O
  • H donors: 2 H acceptors: 1 LogP: 4.72 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc2c(c1)cccc2)CCCc1c[nH]c2c1cccc2
  • InChi: 1S/C22H20N2O/c25-22(24-19-13-12-16-6-1-2-7-17(16)14-19)11-5-8-18-15-23-21-10-4-3-9-20(18)21/h1-4,6-7,9-10,12-15,23H,5,8,11H2,(H,24,25)
  • InChiKey: HJBRHIIDJGRZBL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-(1H-indol-3-yl)-N-(2-naphthyl)butanamide
  • 4-(1H-indol-3-yl)-N-(2-naphthyl)butyramide
  • 4-(1H-indol-3-yl)-N-naphthalen-2-yl-butanamide
  • SMR000256003
  • T5222653
  • ZINC03314590
  • MLS000389729

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 lamin A/C Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
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
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Brugia malayi intermediate filament protein 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
Schistosoma mansoni intermediate filament proteins 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
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis 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 musashi Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis lamin 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
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein 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 microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein 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
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 pyruvate kinase 0.0033 0.028 0.0159
Brugia malayi ATPase, AAA family protein 0.0026 0.0193 0.0557
Echinococcus granulosus dnaJ subfamily B 0.0494 0.5878 0.5874
Trypanosoma cruzi katanin-like protein, putative 0.0026 0.0193 0.0000043848
Loa Loa (eye worm) hypothetical protein 0.0019 0.011 0.0293
Brugia malayi SAP1 protein 0.0026 0.0193 0.0557
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0311 0.0229
Echinococcus multilocularis pyruvate kinase 0.0033 0.028 0.0271
Echinococcus granulosus pyruvate kinase 0.0017 0.0085 0.0076
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.011 0.0101
Trichomonas vaginalis pyruvate kinase, putative 0.0033 0.028 0.0151
Loa Loa (eye worm) hypothetical protein 0.0294 0.3455 1
Echinococcus granulosus GPCR family 2 0.0019 0.011 0.0101
Trichomonas vaginalis proteasome-activating nucleotidase, putative 0.0119 0.132 0.195
Echinococcus granulosus fidgetin protein 1 0.0026 0.0193 0.0184
Loa Loa (eye worm) hypothetical protein 0.0032 0.0267 0.0749
Trypanosoma cruzi katanin, putative 0.0026 0.0193 0.0000043848
Brugia malayi vps4b-prov protein 0.0026 0.0193 0.0557
Loa Loa (eye worm) pyruvate kinase 0.0033 0.028 0.0786
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0016 0.0069 0.0061
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0677 0.1005
Schistosoma mansoni pyruvate kinase 0.0033 0.028 0.0197
Trypanosoma cruzi katanin, putative 0.0026 0.0193 0.0000043848
Trypanosoma brucei Valosin-containing protein 0.0476 0.5663 1
Loa Loa (eye worm) vesicle-fusing ATPase 0.0294 0.3455 1
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0476 0.5663 0.5626
Schistosoma mansoni lamin 0.0033 0.0274 0.0191
Schistosoma mansoni intermediate filament proteins 0.0033 0.0274 0.0191
Trypanosoma cruzi metalloprotease, putative 0.0026 0.0193 0.0000043848
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0208 0.24 0.6948
Loa Loa (eye worm) ATPase 0.0026 0.0193 0.0533
Entamoeba histolytica hypothetical protein 0.0036 0.0311 0.0278
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0274 0.077
Entamoeba histolytica cdc48-like protein, putative 0.0476 0.5663 1
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0274 0.0793
Echinococcus multilocularis pyruvate kinase 0.0033 0.028 0.0271
Loa Loa (eye worm) hypothetical protein 0.0023 0.0158 0.0434
Loa Loa (eye worm) fidgetin protein 0.0026 0.0193 0.0533
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.011 0.0101
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0311 0.0303
Trypanosoma brucei pyruvate kinase 1, putative 0.0033 0.028 0.0159
Echinococcus granulosus pyruvate kinase 0.0017 0.0085 0.0076
Plasmodium vivax cell division cycle ATPase, putative 0.0182 0.2087 0.3589
Trypanosoma cruzi pyruvate kinase 2, putative 0.0033 0.028 0.016
Echinococcus granulosus vacuolar protein sorting associated protein 4A 0.0026 0.0193 0.0184
Echinococcus granulosus lamin 0.0033 0.0274 0.0265
Loa Loa (eye worm) hypothetical protein 0.0033 0.028 0.0786
Echinococcus granulosus intermediate filament protein 0.0033 0.0274 0.0265
Trypanosoma cruzi katanin, putative 0.0026 0.0193 0.0000043848
Plasmodium falciparum vacuolar protein sorting-associated protein 4 0.0026 0.0193 0.0194
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0007 0.0021
Echinococcus granulosus lamin dm0 0.0033 0.0274 0.0265
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0311 0.0303
Schistosoma mansoni hypothetical protein 0.0019 0.011 0.0026
Leishmania major pyruvate kinase 0.0033 0.028 0.0159
Loa Loa (eye worm) VCP protein 0.0208 0.24 0.694
Loa Loa (eye worm) hypothetical protein 0.0015 0.0062 0.0155
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.0476 0.5663 1
Toxoplasma gondii katanin-like family protein 0.0026 0.0193 0.0183
Schistosoma mansoni cpg binding protein 0.0037 0.0324 0.0241
Echinococcus multilocularis katanin p60 ATPase containing subunit A1 0.0026 0.0193 0.0184
Loa Loa (eye worm) pyruvate kinase-PB 0.0023 0.0158 0.0434
Echinococcus multilocularis cpg binding protein 0.0037 0.0324 0.0315
Toxoplasma gondii pyruvate kinase PyK1 0.0033 0.028 0.0331
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.0476 0.5663 1
Trichomonas vaginalis spermatogenesis associated factor, putative 0.0502 0.5977 1
Echinococcus granulosus pyruvate kinase 0.0033 0.028 0.0271
Loa Loa (eye worm) hypothetical protein 0.0041 0.0378 0.1072
Schistosoma mansoni hypothetical protein 0.0036 0.0311 0.0229
Loa Loa (eye worm) hypothetical protein 0.0033 0.0274 0.077
Giardia lamblia Pyruvate kinase 0.0033 0.028 0.0567
Echinococcus granulosus geminin 0.0205 0.2364 0.2357
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.011 0.0318
Brugia malayi Pyruvate kinase, M2 isozyme 0.0033 0.028 0.081
Giardia lamblia Topoisomerase II 0.0026 0.0193 0.0314
Entamoeba histolytica vacuolar sorting protein-associating protein 4A (VPS4), putative 0.0026 0.0193 0.0062
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.028 0.001
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0772 0.0693
Echinococcus multilocularis musashi 0.0033 0.0274 0.0265
Brugia malayi Pyruvate kinase, muscle isozyme 0.0033 0.028 0.081
Echinococcus multilocularis GPCR, family 2 0.0019 0.011 0.0101
Brugia malayi intermediate filament protein 0.0033 0.0274 0.0793
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.009 0.0237
Schistosoma mansoni hypothetical protein 0.0041 0.0378 0.0296
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.03 0.3528 0.5844
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.028 0.001
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.0476 0.5663 1
Schistosoma mansoni hypothetical protein 0.0019 0.011 0.0026
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0378 0.1095
Loa Loa (eye worm) hypothetical protein 0.0016 0.0069 0.0176
Brugia malayi CXXC zinc finger family protein 0.0035 0.03 0.0868
Chlamydia trachomatis pyruvate kinase 0.0033 0.028 0.5
Trichomonas vaginalis 26S protease regulatory subunit S10b, putative 0.0119 0.132 0.195
Echinococcus granulosus katanin p60 ATPase containing subunit A1 0.0026 0.0193 0.0184
Toxoplasma gondii cell division protein CDC48AP 0.03 0.3528 0.5844
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.061 0.1744
Mycobacterium ulcerans ATPase 0.03 0.3528 1
Entamoeba histolytica hypothetical protein 0.0036 0.0311 0.0278
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.011 0.0101
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.011 0.0101
Entamoeba histolytica ATPase, Vps4 oligomerisation domain containing protein 0.0026 0.0193 0.0062
Giardia lamblia Katanin 0.0026 0.0193 0.0314
Giardia lamblia SKD1 protein 0.0026 0.0193 0.0314
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.0502 0.5977 1
Schistosoma mansoni cpg binding protein 0.0035 0.03 0.0217
Brugia malayi hypothetical protein 0.0036 0.0311 0.0901
Entamoeba histolytica hypothetical protein 0.0036 0.0311 0.0278
Trypanosoma cruzi katanin, putative 0.0026 0.0193 0.0000043848
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.028 0.001
Trypanosoma cruzi vesicular transport protein (CDC48 homologue), putative 0.0026 0.0193 0.0000043848
Echinococcus multilocularis lamin dm0 0.0033 0.0274 0.0265
Loa Loa (eye worm) pyruvate kinase 0.0033 0.028 0.0786
Schistosoma mansoni hypothetical protein 0.0019 0.011 0.0026
Echinococcus multilocularis fidgetin protein 1 0.0026 0.0193 0.0184
Schistosoma mansoni hypothetical protein 0.0205 0.2364 0.2299
Plasmodium falciparum pyruvate kinase 0.0033 0.028 0.035
Echinococcus multilocularis pyruvate kinase 0.0026 0.0195 0.0187
Loa Loa (eye worm) vps4b-prov protein 0.0026 0.0193 0.0533
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0208 0.24 0.2336
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0274 0.077
Brugia malayi fidgetin protein 0.0026 0.0193 0.0557
Trypanosoma cruzi pyruvate kinase 2, putative 0.0033 0.028 0.016
Mycobacterium leprae Probable pyruvate kinase PykA 0.0033 0.028 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.061 0.1765
Onchocerca volvulus 0.0035 0.03 0.0045
Echinococcus granulosus pyruvate kinase 0.0033 0.028 0.0271
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0502 0.5977 0.5973
Loa Loa (eye worm) hypothetical protein 0.006 0.061 0.1744
Echinococcus multilocularis geminin 0.0205 0.2364 0.2357
Loa Loa (eye worm) pyruvate kinase 0.0033 0.028 0.0786
Giardia lamblia AAA family ATPase 0.03 0.3528 1
Schistosoma mansoni lamin 0.0033 0.0274 0.0191
Schistosoma mansoni hypothetical protein 0.0205 0.2364 0.2299
Toxoplasma gondii cell division protein CDC48CY 0.0502 0.5977 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.061 0.1765
Schistosoma mansoni hypothetical protein 0.0019 0.011 0.0026
Entamoeba histolytica hypothetical protein 0.0036 0.0311 0.0278
Trichomonas vaginalis pyruvate kinase, putative 0.0033 0.028 0.0151
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0208 0.24 0.2394
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0016 0.0069 0.0061
Trypanosoma cruzi vacuolar protein sorting-associated protein 4, putative 0.0026 0.0193 0.0000043848
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.011 0.0293
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Echinococcus granulosus transitional endoplasmic reticulum atpase 0.0502 0.5977 0.5973
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.03 0.0844
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0502 0.5977 0.5943
Echinococcus multilocularis pyruvate kinase 0.0017 0.0085 0.0076
Echinococcus multilocularis pyruvate kinase 0.0017 0.0085 0.0076
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.0476 0.5663 1
Trypanosoma cruzi katanin, putative 0.0026 0.0193 0.0000043848
Schistosoma mansoni hypothetical protein 0.0026 0.0193 0.0109
Schistosoma mansoni pyruvate kinase 0.0033 0.028 0.0197
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.5878 0.5874
Plasmodium vivax pyruvate kinase, putative 0.0033 0.028 0.035
Echinococcus granulosus pyruvate kinase 0.0017 0.0085 0.0076
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.009 0.0262
Schistosoma mansoni cpg binding protein 0.0037 0.0324 0.0241
Brugia malayi valosin containing protein 0.0294 0.3455 1
Echinococcus multilocularis vacuolar protein sorting associated protein 4A 0.0026 0.0193 0.0184
Trypanosoma cruzi vacuolar transport protein 4A, putative 0.0026 0.0193 0.0000043848
Loa Loa (eye worm) hypothetical protein 0.0015 0.0062 0.0155
Schistosoma mansoni skd/vacuolar sorting 0.0026 0.0193 0.0109
Echinococcus granulosus cpg binding protein 0.0037 0.0324 0.0315
Echinococcus multilocularis lamin 0.0033 0.0274 0.0265
Mycobacterium tuberculosis Putative conserved ATPase 0.03 0.3528 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.011 0.0318
Trypanosoma brucei pyruvate kinase 1 0.0033 0.028 0.0159
Trypanosoma cruzi Valosin-containing protein, putative 0.0476 0.5663 1
Echinococcus multilocularis pyruvate kinase 0.0017 0.0085 0.0076
Giardia lamblia SKD1 protein 0.0026 0.0193 0.0314
Schistosoma mansoni hypothetical protein 0.0494 0.5878 0.5843
Brugia malayi vesicle-fusing ATPase 0.0294 0.3455 1

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) = 0.8913 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 4.6109 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 8.9125 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of Mitochondrial Division or Activators of Mitochondrial Fusion. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (binding) 28.1838 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 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) 31.6228 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) 31.6228 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 35.4813 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) = 39.8107 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the ERK Signaling Pathway using a Homogeneous Screening Assay; Stimulation with EGF. (Class of assay: confirmatory) [Related pubchem assays: 995 ] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] 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) 56.2341 uM PUBCHEM_BIOASSAY: qHTS assay for re-activators of p53 using a Luc reporter. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504709] ChEMBL. No reference
Potency (functional) 89.1251 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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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