Detailed information for compound 1390630

Basic information

Technical information
  • TDR Targets ID: 1390630
  • Name: 1-[4-(phenylmethoxy)phenoxy]-3-piperidin-1-yl propan-2-ol
  • MW: 341.444 | Formula: C21H27NO3
  • H donors: 1 H acceptors: 1 LogP: 3.62 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(CN1CCCCC1)COc1ccc(cc1)OCc1ccccc1
  • InChi: 1S/C21H27NO3/c23-19(15-22-13-5-2-6-14-22)17-25-21-11-9-20(10-12-21)24-16-18-7-3-1-4-8-18/h1,3-4,7-12,19,23H,2,5-6,13-17H2
  • InChiKey: DWUSGPIVURZHPP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[4-(phenylmethoxy)phenoxy]-3-(1-piperidyl)propan-2-ol
  • 1-[4-(benzyloxy)phenoxy]-3-piperidino-propan-2-ol
  • 1-[4-(phenylmethoxy)phenoxy]-3-piperidin-1-yl-propan-2-ol
  • Oprea1_732191
  • ST072794
  • Oprea1_193857
  • 1-[4-(benzyloxy)phenoxy]-3-(1-piperidinyl)-2-propanol
  • MLS000062913
  • SMR000073890
  • 1-(4-Benzyloxy-phenoxy)-3-piperidin-1-yl-propan-2-ol
  • BAS 06111205

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Inositol monophosphatase 1 Starlite/ChEMBL No references
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens tumor protein p53 Starlite/ChEMBL No references
Homo sapiens breast cancer 1, early onset Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
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
Entamoeba histolytica myo-inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Mycobacterium ulcerans extragenic suppressor protein SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis inositol monophosphatase, putative 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
Brugia malayi Inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Neospora caninum hypothetical protein Get druggable targets OG5_126810 All targets in OG5_126810
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
Trypanosoma congolense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis myo inositol monophosphatase, putative 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
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 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
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus multilocularis tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Leishmania infantum myo-inositol-1(or 4)-monophosphatase 1, 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
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) inositol-1 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
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Echinococcus multilocularis inositol monophosphatase 1 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
Leishmania braziliensis myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 263 aa 24.0 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 287 aa 22.3 %
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 309 aa 27.8 %
Brugia malayi Inositol monophosphatase family protein Inositol monophosphatase 1   277 aa 238 aa 21.8 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 258 aa 21.7 %
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 %
Trypanosoma cruzi myo-inositol-1 phosphatase, putative Inositol monophosphatase 1   277 aa 284 aa 30.6 %
Trypanosoma congolense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 28.9 %
Trypanosoma brucei inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 27.3 %
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 %
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Trichomonas vaginalis myo inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 276 aa 21.4 %
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative Inositol monophosphatase 1   277 aa 263 aa 21.7 %
Onchocerca volvulus Putative trans-2-enoyl-CoA reductase 1, mitochondrial Inositol monophosphatase 1   277 aa 278 aa 23.0 %
Onchocerca volvulus Putative 28S ribosomal protein S10, mitochondrial Inositol monophosphatase 1   277 aa 271 aa 46.1 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase 1 Inositol monophosphatase 1   277 aa 275 aa 22.2 %
Schistosoma japonicum ko:K01082 3'(2'), 5'-bisphosphate nucleotidase [EC3.1.3.7], putative Inositol monophosphatase 1   277 aa 275 aa 21.5 %
Loa Loa (eye worm) hypothetical protein Inositol monophosphatase 1   277 aa 298 aa 23.8 %
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 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 268 aa 22.4 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase Inositol monophosphatase 1   277 aa 230 aa 25.2 %
Schistosoma mansoni pap-inositol-14-phosphatase Inositol monophosphatase 1   277 aa 279 aa 22.9 %
Trypanosoma cruzi inositol polyphosphate 1-phosphatase, putative Inositol monophosphatase 1   277 aa 291 aa 23.7 %
Onchocerca volvulus Inositol monophosphatase 1   277 aa 238 aa 22.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni jumonji domain containing protein 0.0073 0.0235 0.0734
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0187 0.075 0.1053
Brugia malayi hypothetical protein 0.012 0.0444 0.0613
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0095 0.0331 0.1246
Echinococcus multilocularis lysine specific demethylase 5A 0.0034 0.0057 0.008
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.05 0.2164 0.6773
Entamoeba histolytica hypothetical protein 0.0043 0.0099 0.031
Brugia malayi jmjC domain containing protein 0.0034 0.0057 0.0079
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0006 0.0009
Loa Loa (eye worm) hypothetical protein 0.0432 0.1859 0.7368
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0243 0.1004 0.3142
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0095 0.0331 0.1037
Schistosoma mansoni lozenge 0.0054 0.0148 0.0463
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.003 0.0113
Plasmodium vivax hypothetical protein, conserved 0.0028 0.003 0.0113
Echinococcus granulosus protein kinase shaggy 0.0187 0.075 0.2346
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0099 0.031
Leishmania major hypothetical protein, conserved 0.0025 0.0014 0.0052
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0045 0.0104 0.596
Echinococcus multilocularis inositol monophosphatase 1 0.0045 0.0104 0.0147
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0095 0.0331 0.0458
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.0171 0.024
Giardia lamblia Telomerase catalytic subunit 0.061 0.2661 1
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0728 0.3195 0.449
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.0104 0.0326
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0728 0.3195 1
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0104 0.0392
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.0171 0.0642
Plasmodium falciparum phd finger protein, putative 0.0028 0.003 0.0113
Loa Loa (eye worm) hypothetical protein 0.0049 0.0123 0.0486
Echinococcus multilocularis tumor protein p63 0.0408 0.1748 0.2457
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0243 0.1004 0.3142
Brugia malayi Inositol-1 0.0045 0.0104 0.0144
Leishmania major phosphatidylinositol 3-kinase, putative 0.0095 0.0331 0.1246
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0579 0.2523 0.7895
Echinococcus granulosus lysine specific demethylase 5A 0.0034 0.0057 0.0178
Schistosoma mansoni inositol monophosphatase 0.0045 0.0104 0.0326
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0095 0.0331 0.1246
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.061 0.2661 0.8327
Echinococcus granulosus microtubule associated protein 2 0.0668 0.2924 0.915
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.003 0.0119
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0006 0.0369
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.0171 1
Brugia malayi Bromodomain containing protein 0.0028 0.003 0.0042
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0045 0.0104 0.0326
Brugia malayi hypothetical protein 0.0025 0.0014 0.0019
Brugia malayi MH2 domain containing protein 0.0116 0.0425 0.0587
Brugia malayi Telomerase reverse transcriptase 0.1623 0.7242 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.017 0.0673 0.2528
Loa Loa (eye worm) hypothetical protein 0.0023 0.0006 0.0025
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.1595 0.7117 1
Plasmodium falciparum telomerase reverse transcriptase 0.061 0.2661 1
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0095 0.0331 0.1246
Schistosoma mansoni microtubule-associated protein tau 0.0668 0.2924 0.915
Loa Loa (eye worm) hypothetical protein 0.0471 0.2035 0.8067
Echinococcus multilocularis protein kinase shaggy 0.0187 0.075 0.1053
Trypanosoma brucei protein kinase, putative 0.0187 0.075 0.2817
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0095 0.0331 0.1037
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0471 0.2035 0.286
Entamoeba histolytica protein kinase domain containing protein 0.0187 0.075 0.2346
Schistosoma mansoni cellular tumor antigen P53 0.006 0.0173 0.054
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0323 0.1363 0.4265
Trichomonas vaginalis CMGC family protein kinase 0.0187 0.075 0.2346
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0006 0.002
Echinococcus multilocularis peregrin 0.0028 0.003 0.0042
Loa Loa (eye worm) hypothetical protein 0.0048 0.0121 0.0481
Loa Loa (eye worm) runx1 0.0054 0.0148 0.0586
Loa Loa (eye worm) hypothetical protein 0.0028 0.003 0.0119
Leishmania major telomerase reverse transcriptase, putative 0.061 0.2661 1
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0014 0.0052
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0222 0.0906 0.2837
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0171 1
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.004 0.0083 0.487
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0014 0.0052
Echinococcus granulosus jumonji domain containing protein 0.0039 0.008 0.0251
Loa Loa (eye worm) jmjC domain-containing protein 0.0034 0.0057 0.0226
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0014 0.0052
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0095 0.0331 0.1037
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0095 0.0331 0.1246
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0187 0.075 0.2817
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0123 0.0169
Loa Loa (eye worm) hypothetical protein 0.0023 0.0006 0.0025
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0006 0.0024
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0187 0.075 0.2971
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0095 0.0331 0.1037
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0243 0.1004 0.3142
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0187 0.075 0.2346
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0095 0.0331 0.1037
Entamoeba histolytica hypothetical protein 0.0043 0.0099 0.031
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0014 0.0052
Echinococcus granulosus tumor protein p63 0.0408 0.1748 0.5472
Loa Loa (eye worm) phosphatidylinositol 3 0.0222 0.0906 0.3593
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0351 0.1492 0.5606
Onchocerca volvulus 0.0023 0.0006 0.0006
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0095 0.0331 0.1314
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.003 0.0042
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0471 0.2035 0.281
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0006 0.002
Loa Loa (eye worm) phosphatidylinositol 3 0.0579 0.2523 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0058 0.0166 0.0658
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0187 0.075 0.2971
Loa Loa (eye worm) hypothetical protein 0.012 0.0444 0.1758
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0095 0.0331 0.1246
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0471 0.2035 0.6369
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.0171 0.0534
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.0171 0.0642
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0014 0.0043
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0045 0.0104 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.05 0.2164 0.6773
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0095 0.0331 0.1037
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0006 0.0758
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0006 0.0024
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0187 0.075 0.2346
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0095 0.0331 0.1246
Loa Loa (eye worm) hypothetical protein 0.012 0.0444 0.1758
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0728 0.3195 1
Entamoeba histolytica protein kinase domain containing protein 0.0187 0.075 0.2346
Brugia malayi jmjC domain containing protein 0.0092 0.0321 0.0443
Onchocerca volvulus 0.006 0.0173 0.0173
Brugia malayi intracellular kinase 0.0187 0.075 0.1035
Schistosoma mansoni inositol monophosphatase 0.0045 0.0104 0.0326
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0006 0.0009
Echinococcus granulosus peregrin 0.0028 0.003 0.0094
Loa Loa (eye worm) inositol-1 0.0045 0.0104 0.0413
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0243 0.1004 0.3774
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.061 0.2661 0.8327
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0006 0.0009
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0243 0.1004 0.3142
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0187 0.075 0.2817
Onchocerca volvulus Huntingtin homolog 0.012 0.0444 0.0444
Loa Loa (eye worm) hypothetical protein 0.0025 0.0014 0.0055
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0057 0.0178
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0243 0.1004 0.3142
Trichomonas vaginalis inositol monophosphatase, putative 0.0045 0.0104 0.0326
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0728 0.3195 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0095 0.0331 0.1037
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0728 0.3195 0.4412
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.004 0.0083 1
Onchocerca volvulus 0.0187 0.075 0.075
Entamoeba histolytica hypothetical protein 0.0043 0.0099 0.031
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0095 0.0331 0.0466
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0014 0.0052
Schistosoma mansoni hypothetical protein 0.0033 0.0053 0.0166
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0728 0.3195 1
Giardia lamblia PHD finger protein 15 0.0028 0.003 0.0113
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0171 1
Loa Loa (eye worm) hypothetical protein 0.0432 0.1859 0.7368
Toxoplasma gondii RNA-directed DNA polymerase 0.061 0.2661 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0045 0.0104 0.0392
Giardia lamblia Kinase, CMGC GSK 0.0187 0.075 0.2817
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0104 0.0326
Trichomonas vaginalis CMGC family protein kinase 0.0187 0.075 0.2346
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0104 0.0326
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.003 0.0094
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0728 0.3195 1
Brugia malayi hypothetical protein 0.0432 0.1859 0.2567
Onchocerca volvulus 0.0432 0.1859 0.1859
Entamoeba histolytica hypothetical protein 0.0043 0.0099 0.031
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0728 0.3195 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0104 0.0392
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0095 0.0331 0.1037
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0053 0.0073
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0187 0.075 0.2346
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0243 0.1004 0.1386
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0095 0.0331 0.1037
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.0425 0.1685
Echinococcus multilocularis Zinc finger, PHD finger 0.0095 0.0331 0.0466
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0006 0.0024
Entamoeba histolytica protein kinase, putative 0.0187 0.075 0.2346
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0006 0.0369
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0171 0.0534
Entamoeba histolytica hypothetical protein 0.0579 0.2523 0.7895
Echinococcus multilocularis Protein lozenge 0.0054 0.0148 0.0208
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0095 0.0331 0.1037
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0728 0.3195 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0243 0.1004 0.3142
Loa Loa (eye worm) hypothetical protein 0.006 0.0173 0.0684
Brugia malayi hypothetical protein 0.0043 0.0099 0.0137
Loa Loa (eye worm) hypothetical protein 0.0256 0.1063 0.4212
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0123 0.0486
Giardia lamblia Kinase, CMGC GSK 0.0187 0.075 0.2817
Echinococcus multilocularis microtubule associated protein 2 0.0668 0.2924 0.4108
Trypanosoma brucei telomerase reverse transcriptase 0.061 0.2661 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0099 0.0139
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0006 0.0758
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0099 0.031
Brugia malayi PHD-finger family protein 0.0028 0.003 0.0042
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0092 0.0321 0.045
Plasmodium vivax glycogen synthase kinase 3, putative 0.0187 0.075 0.2817
Onchocerca volvulus Alhambra homolog 0.0028 0.003 0.003
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0706 0.3098 0.9695
Echinococcus granulosus inositol monophosphatase 1 0.0045 0.0104 0.0326
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0092 0.0321 0.1003
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.0104 0.0326
Plasmodium falciparum glycogen synthase kinase 3 0.0187 0.075 0.2817
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0123 0.0169
Loa Loa (eye worm) hypothetical protein 0.0023 0.0006 0.0025
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0171 0.0534
Onchocerca volvulus Huntingtin homolog 0.012 0.0444 0.0444
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0243 0.1004 0.3142
Loa Loa (eye worm) hypothetical protein 0.0033 0.0053 0.021
Schistosoma mansoni hypothetical protein 0.0043 0.0099 0.031
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.003 0.0094
Echinococcus multilocularis jumonji domain containing protein 0.0039 0.008 0.0113
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0171 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0728 0.3195 1
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0095 0.0331 0.1037
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.003 0.0113
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0057 0.0178
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0014 0.0043
Schistosoma mansoni hypothetical protein 0.0028 0.003 0.0094
Plasmodium vivax telomerase reverse transcriptase, putative 0.061 0.2661 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.0425 0.1685
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0006 0.002

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.3096 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) = 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) 12.9953 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) 15.8489 uM PubChem BioAssay. qHTS Assay to Identify Small Molecule Activators of BRCA1 Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.3601 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 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 (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HSD17B4, hydroxysteroid (17-beta) dehydrogenase 4. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) 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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