Detailed information for compound 1373683

Basic information

Technical information
  • TDR Targets ID: 1373683
  • Name: 2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-6-propyl -1H-pyrimidin-4-one
  • MW: 334.433 | Formula: C17H22N2O3S
  • H donors: 1 H acceptors: 3 LogP: 4.22 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCc1nc(SCCOc2ccc(cc2)OCC)nc(c1)O
  • InChi: 1S/C17H22N2O3S/c1-3-5-13-12-16(20)19-17(18-13)23-11-10-22-15-8-6-14(7-9-15)21-4-2/h6-9,12H,3-5,10-11H2,1-2H3,(H,18,19,20)
  • InChiKey: PQIJVQFNGOHQCU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[2-(4-ethoxyphenoxy)ethylthio]-6-propyl-1H-pyrimidin-4-one
  • MLS000568473
  • SMR000154640
  • ZINC05695386
  • T0515-3211

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Rattus norvegicus Inositol monophosphatase 1 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
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Entamoeba histolytica myo-inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) hypothetical protein 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 multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma congolense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans extragenic suppressor protein SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni mixed-lineage leukemia protein mll 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
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Neospora caninum hypothetical protein Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania mexicana myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K01092 myo-inositol-1(or 4)-monophosphatase [EC3.1.3.25], putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania donovani myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania infantum myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Trichomonas vaginalis inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania braziliensis myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
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 mansoni lamin 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
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 258 aa 21.7 %
Onchocerca volvulus Putative 28S ribosomal protein S10, mitochondrial Inositol monophosphatase 1   277 aa 271 aa 46.1 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase Inositol monophosphatase 1   277 aa 230 aa 25.2 %
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 309 aa 27.8 %
Trypanosoma congolense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 28.9 %
Onchocerca volvulus Putative trans-2-enoyl-CoA reductase 1, mitochondrial Inositol monophosphatase 1   277 aa 278 aa 23.0 %
Trypanosoma brucei inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 27.3 %
Schistosoma mansoni pap-inositol-14-phosphatase Inositol monophosphatase 1   277 aa 279 aa 22.9 %
Trichomonas vaginalis myo inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 276 aa 21.4 %
Loa Loa (eye worm) hypothetical protein Inositol monophosphatase 1   277 aa 298 aa 23.8 %
Brugia malayi Inositol monophosphatase family protein Inositol monophosphatase 1   277 aa 238 aa 21.8 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 287 aa 22.3 %
Schistosoma japonicum ko:K01082 3'(2'), 5'-bisphosphate nucleotidase [EC3.1.3.7], putative Inositol monophosphatase 1   277 aa 275 aa 21.5 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 300 aa 22.0 %
Onchocerca volvulus Inositol monophosphatase 1   277 aa 238 aa 22.7 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Trypanosoma cruzi myo-inositol-1 phosphatase, putative Inositol monophosphatase 1   277 aa 284 aa 30.6 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 306 aa 22.5 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase 1 Inositol monophosphatase 1   277 aa 275 aa 22.2 %
Trypanosoma cruzi inositol polyphosphate 1-phosphatase, putative Inositol monophosphatase 1   277 aa 291 aa 23.7 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 307 aa 22.5 %
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative Inositol monophosphatase 1   277 aa 263 aa 21.7 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 263 aa 24.0 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 268 aa 22.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.5824 1
Schistosoma mansoni intermediate filament proteins 0.0033 0.4088 0.4049
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.4393 0.7515
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.1908 0.3199
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.9966 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0005 0.0109 0.0044
Brugia malayi CXXC zinc finger family protein 0.0035 0.4393 0.7515
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.4088 0.6985
Loa Loa (eye worm) hypothetical protein 0.0033 0.4088 0.6985
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0939 0.0882
Trichomonas vaginalis helicase, putative 0.0008 0.0525 0.0902
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0045 0.5824 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Onchocerca volvulus 0.0033 0.4088 0.9295
Schistosoma mansoni cpg binding protein 0.0037 0.4678 0.4643
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.092 0.1482
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0525 0.0902
Loa Loa (eye worm) hypothetical protein 0.0015 0.1572 0.2616
Brugia malayi intermediate filament protein 0.0033 0.4088 0.6985
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.9966 1
Trichomonas vaginalis inositol monophosphatase, putative 0.0005 0.0066 0.0113
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.004 0.515 0.5135
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.9966 0.9966
Echinococcus multilocularis lamin 0.0033 0.4088 0.4063
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.9966 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Echinococcus multilocularis cpg binding protein 0.0037 0.4678 0.4659
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0005 0.0066 0.0113
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0939 0.0882
Loa Loa (eye worm) inositol-1 0.0045 0.5824 1
Onchocerca volvulus 0.0033 0.4088 0.9295
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Echinococcus granulosus mixed lineage leukemia protein mll 0.0009 0.0634 0.0574
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.4088 0.6985
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0634 0.0574
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0634 0.0572
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.9966 0.9966
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.9966 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0009 0.0634 0.0574
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0016 0.1658 0.1608
Schistosoma mansoni cpg binding protein 0.0035 0.4393 0.4356
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.1908 0.3199
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0634 0.0574
Chlamydia trachomatis 3'(2'),5'-bisphosphate nucleotidase CysQ 0.0005 0.0066 0.5
Schistosoma mansoni inositol monophosphatase 0.0045 0.5824 0.5796
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.5824 0.5816
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.5824 1
Loa Loa (eye worm) intermediate filament protein 0.0033 0.4088 0.6985
Echinococcus multilocularis lamin dm0 0.0033 0.4088 0.4063
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.004 0.515 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.1658 0.2765
Echinococcus granulosus intermediate filament protein 0.0033 0.4088 0.4063
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Loa Loa (eye worm) hypothetical protein 0.0015 0.1572 0.2616
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0525 0.0902
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.5824 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0045 0.5824 0.5816
Schistosoma mansoni cpg binding protein 0.0037 0.4678 0.4643
Echinococcus multilocularis musashi 0.0033 0.4088 0.4063
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0045 0.5824 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.5824 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.9966 1
Onchocerca volvulus 0.0035 0.4393 1
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative 0.0005 0.0066 0.0113
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Echinococcus granulosus cpg binding protein 0.0037 0.4678 0.4659
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0045 0.5824 0.5816
Echinococcus granulosus inositol monophosphatase 1 0.0045 0.5824 0.5816
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0939 0.1517
Trichomonas vaginalis inositol monophosphatase, putative 0.0005 0.0066 0.0113
Echinococcus granulosus lamin 0.0033 0.4088 0.4063
Schistosoma mansoni lamin 0.0033 0.4088 0.4049
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.9966 1
Giardia lamblia Hypothetical protein 0.0005 0.0066 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0525 0.0902
Echinococcus granulosus lamin dm0 0.0033 0.4088 0.4063
Schistosoma mansoni lamin 0.0033 0.4088 0.4049
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.9966 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0016 0.1658 0.1608
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.5824 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.9966 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0525 0.0902
Echinococcus multilocularis inositol monophosphatase 1 0.0045 0.5824 0.5816
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.8867 0.889
Schistosoma mansoni inositol monophosphatase 0.0045 0.5824 0.5796
Trichomonas vaginalis inositol monophosphatase, putative 0.0045 0.5824 1
Brugia malayi Inositol-1 0.0045 0.5824 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.4002 0.6836

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.5481 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors: Potentiation with Lithium. (Class of assay: confirmatory) [Related pubchem assays: 901 ] ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 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) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 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

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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