Detailed information for compound 1386395

Basic information

Technical information
  • TDR Targets ID: 1386395
  • Name: (5-amino-1-phenylsulfonylpyrazol-3-yl) 2-meth oxybenzoate
  • MW: 373.383 | Formula: C17H15N3O5S
  • H donors: 1 H acceptors: 4 LogP: 3.38 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1C(=O)Oc1cc(n(n1)S(=O)(=O)c1ccccc1)N
  • InChi: 1S/C17H15N3O5S/c1-24-14-10-6-5-9-13(14)17(21)25-16-11-15(18)20(19-16)26(22,23)12-7-3-2-4-8-12/h2-11H,18H2,1H3
  • InChiKey: XZFHHLUQIWUFPX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (5-amino-1-phenylsulfonyl-pyrazol-3-yl) 2-methoxybenzoate
  • 2-methoxybenzoic acid (5-amino-1-phenylsulfonyl-3-pyrazolyl) ester
  • 2-methoxybenzoic acid (5-amino-1-phenylsulfonyl-pyrazol-3-yl) ester
  • ZINC04251531
  • Oprea1_243529
  • MLS000680210
  • SMR000324475
  • EU-0053857

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed), beta Starlite/ChEMBL No references
Schistosoma mansoni Thioredoxin glutathione reductase Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Leishmania donovani mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Toxoplasma gondii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania braziliensis mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Plasmodium yoelii glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Leishmania donovani trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi Thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trypanosoma congolense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Cryptosporidium parvum thioredoxin reductase 1 Get druggable targets OG5_126785 All targets in OG5_126785
Babesia bovis thiodoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
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
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Trypanosoma cruzi trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis Conserved hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Schistosoma japonicum ko:K00384 thioredoxin reductase (NADPH) [EC1.8.1.9], putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium yoelii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania mexicana trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania mexicana mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Plasmodium falciparum thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei gambiense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania major trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma congolense mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Leishmania infantum mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Plasmodium vivax thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania major mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Neospora caninum Glutathione reductase, related Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Plasmodium berghei thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Theileria parva thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium berghei glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei gambiense mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Cryptosporidium hominis thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trypanosoma brucei mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Neospora caninum MGC84926 protein, related Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania infantum trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania braziliensis trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin glutathione reductase   598 aa 537 aa 24.2 %
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin glutathione reductase   598 aa 521 aa 21.5 %
Plasmodium berghei dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin glutathione reductase   598 aa 538 aa 25.3 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Onchocerca volvulus Thioredoxin glutathione reductase   598 aa 533 aa 50.8 %
Neospora caninum hypothetical protein Thioredoxin glutathione reductase   598 aa 485 aa 30.5 %
Toxoplasma gondii NADPH-glutathione reductase Thioredoxin glutathione reductase   598 aa 555 aa 33.5 %
Neospora caninum Dihydrolipoyl dehydrogenase (EC 1.8.1.4), related Thioredoxin glutathione reductase   598 aa 512 aa 28.3 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast Thioredoxin glutathione reductase   598 aa 513 aa 25.0 %
Neospora caninum glutathione reductase, putative Thioredoxin glutathione reductase   598 aa 532 aa 34.6 %
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative polymerase (DNA directed), beta 335 aa 303 aa 32.3 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin glutathione reductase   598 aa 518 aa 22.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis TGF beta signal transducer SmadC 0.001 0.0015 0.0015
Plasmodium falciparum thioredoxin reductase 0.0046 0.0449 0.0701
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0788 0.0788
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0442 0.525 0.5359
Echinococcus granulosus Smad4 0.001 0.0015 0.0015
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0087 0.0087
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0046 0.0449 0.1212
Schistosoma mansoni smad1 5 8 and 0.001 0.0015 0.0015
Echinococcus multilocularis carbonic anhydrase 0.0442 0.525 0.525
Schistosoma mansoni smad 0.001 0.0015 0.0015
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0517 0.0443
Onchocerca volvulus 0.0035 0.0316 0.5
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 0.4318 0.4363
Mycobacterium tuberculosis Beta-carbonic anhydrase CanB 0.0262 0.3075 1
Mycobacterium leprae CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 0.0462 0.5497 1
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0442 0.525 0.5359
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0104 0.1159 0.3587
Trichomonas vaginalis conserved hypothetical protein 0.02 0.2318 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0104 0.1159 0.3587
Leishmania major mitochondrial DNA polymerase beta 0.0365 0.4318 0.4363
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0442 0.525 0.5359
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0442 0.525 0.5359
Schistosoma mansoni carbonic anhydrase 0.0442 0.525 0.525
Mycobacterium tuberculosis Probable dehydrogenase 0.0104 0.1159 0.3587
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Brugia malayi MH2 domain containing protein 0.0144 0.1644 0.1668
Loa Loa (eye worm) carbonic anhydrase 3 0.0815 0.9783 1
Echinococcus multilocularis Smad4 0.001 0.0015 0.0015
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1644 0.1668
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0116 0.13 0.4059
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0104 0.1159 0.3587
Mycobacterium tuberculosis Probable reductase 0.0104 0.1159 0.3587
Echinococcus granulosus smad 0.001 0.0015 0.0015
Schistosoma mansoni cpg binding protein 0.0037 0.034 0.034
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0442 0.525 0.5359
Mycobacterium tuberculosis Conserved hypothetical protein 0.0192 0.2225 0.7155
Schistosoma mansoni TGF-beta signal transducer Smad2 0.001 0.0015 0.0015
Echinococcus granulosus mothers against decapentaplegic 5 0.001 0.0015 0.0015
Loa Loa (eye worm) glutathione reductase 0.0046 0.0449 0.0445
Trichomonas vaginalis conserved hypothetical protein 0.02 0.2318 1
Toxoplasma gondii thioredoxin reductase 0.0046 0.0449 0.0701
Toxoplasma gondii hypothetical protein 0.0442 0.525 1
Mycobacterium ulcerans carbonic anhydrase 0.0462 0.5497 1
Plasmodium falciparum carbonic anhydrase 0.0442 0.525 1
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0815 0.9783 1
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.0087 0.5
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0104 0.1159 0.3587
Trypanosoma cruzi trypanothione reductase, putative 0.0046 0.0449 0.0373
Leishmania major carbonic anhydrase-like protein 0.0815 0.9783 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0365 0.4318 0.4363
Echinococcus granulosus carbonic anhydrase 0.0442 0.525 0.525
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 0.4318 0.4363
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0815 0.9783 1
Brugia malayi Thioredoxin reductase 0.0046 0.0449 0.0445
Schistosoma mansoni carbonic anhydrase-related 0.0442 0.525 0.525
Loa Loa (eye worm) hypothetical protein 0.0442 0.525 0.5359
Echinococcus multilocularis carbonic anhydrase 0.0442 0.525 0.525
Plasmodium vivax thioredoxin reductase, putative 0.0046 0.0449 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0116 0.13 0.0325
Schistosoma mansoni smad1 5 8 and 0.001 0.0015 0.0015
Mycobacterium tuberculosis Probable oxidoreductase 0.0116 0.13 0.4059
Trypanosoma brucei carbonic anhydrase-like protein 0.0815 0.9783 1
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0815 0.9783 1
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Schistosoma mansoni carbonic anhydrase 0.0462 0.5497 0.5497
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0087 0.5
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0815 0.9783 0.9783
Echinococcus granulosus TGF beta signal transducer SmadC 0.001 0.0015 0.0015
Echinococcus multilocularis mothers against decapentaplegic 5 0.001 0.0015 0.0015
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0316 0.0309
Schistosoma mansoni cpg binding protein 0.0035 0.0316 0.0316
Echinococcus granulosus carbonic anhydrase II 0.0815 0.9783 0.9783
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0442 0.525 0.5359
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0024 0.001
Loa Loa (eye worm) hypothetical protein 0.0442 0.525 0.5359
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0116 0.13 0.4059
Plasmodium vivax glutathione reductase, putative 0.0046 0.0449 1
Echinococcus multilocularis carbonic anhydrase II 0.0815 0.9783 0.9783
Schistosoma mansoni cpg binding protein 0.0037 0.034 0.034
Plasmodium falciparum glutathione reductase 0.0046 0.0449 0.0701
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0037 0.0022
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1644 0.1668
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.0517 0.0443
Schistosoma mansoni smad1 5 8 and 0.001 0.0015 0.0015
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0815 0.9783 0.9783
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0087 0.5
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0026 0.0011
Schistosoma mansoni hypothetical protein 0.0442 0.525 0.525
Echinococcus multilocularis thioredoxin glutathione reductase 0.0046 0.0457 0.0457
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0173 0.1988 0.1961
Echinococcus granulosus thioredoxin glutathione reductase 0.0046 0.0457 0.0457
Schistosoma mansoni Smad4 0.001 0.0015 0.0015
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0037 0.0022
Echinococcus granulosus carbonic anhydrase 0.0442 0.525 0.525
Leishmania major trypanothione reductase 0.0046 0.0449 0.0373
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0026 0.0026
Schistosoma mansoni carbonic anhydrase-related 0.0442 0.525 0.525
Echinococcus granulosus cpg binding protein 0.0037 0.034 0.034
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0815 0.9783 1
Echinococcus multilocularis smad 0.001 0.0015 0.0015
Mycobacterium ulcerans hypothetical protein 0.0192 0.2225 0.3951
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0087 0.0087
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0815 0.9783 1
Entamoeba histolytica carbonic anhydrase, putative 0.0462 0.5497 0.5
Brugia malayi CXXC zinc finger family protein 0.0035 0.0316 0.0309
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.1988 0.1961
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0062 0.0653 0.0584
Mycobacterium tuberculosis Probable transmembrane carbonic anhydrase (carbonate dehydratase) (carbonic dehydratase) 0.02 0.2318 0.7466
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0087 0.0075
Loa Loa (eye worm) hypothetical protein 0.0442 0.525 0.5359
Loa Loa (eye worm) thioredoxin reductase 0.0046 0.0449 0.0445
Schistosoma mansoni carbonic anhydrase-related 0.0442 0.525 0.525
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0051 0.0517 0.0443
Echinococcus multilocularis cpg binding protein 0.0037 0.034 0.034
Trypanosoma brucei trypanothione reductase 0.0046 0.0449 0.0373
Treponema pallidum NADH oxidase 0.0016 0.0087 0.5
Echinococcus granulosus carbonic anhydrase 0.0442 0.525 0.525
Brugia malayi glutathione reductase 0.0046 0.0449 0.0445
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.0517 0.0443
Giardia lamblia NADH oxidase lateral transfer candidate 0.0016 0.0087 0.5
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0692 0.1171
Toxoplasma gondii hypothetical protein 0.0059 0.0609 0.101
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.1988 0.1961
Echinococcus multilocularis carbonic anhydrase 0.0442 0.525 0.525
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0087 0.0087
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0026 0.0026
Mycobacterium ulcerans carbonic anhydrase 0.02 0.2318 0.4123
Leishmania major carbonic anhydrase family protein, putative 0.0462 0.5497 0.558

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.3548 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 8.9125 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) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (binding) = 17.7828 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) 25.929 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) = 28.1838 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) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1). (Class of assay: confirmatory) [Related pubchem assays: 594 (Rhodamine region spectral profiling screen), 593 (Fluorescein region spectral profiling screen), 2367 (Probe Development Summary for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1)), 2353 (qHTS Validation Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1))] ChEMBL. No reference
Potency (functional) 63.0957 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 70.7946 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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