Detailed information for compound 1410992

Basic information

Technical information
  • TDR Targets ID: 1410992
  • Name: 4-pyrimidin-2-yloxybenzaldehyde
  • MW: 200.193 | Formula: C11H8N2O2
  • H donors: 0 H acceptors: 3 LogP: 1.53 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=Cc1ccc(cc1)Oc1ncccn1
  • InChi: 1S/C11H8N2O2/c14-8-9-2-4-10(5-3-9)15-11-12-6-1-7-13-11/h1-8H
  • InChiKey: CGSRJSIAGKSMHU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-(2-pyrimidinyloxy)benzaldehyde
  • SBB010177
  • ZINC00168151
  • 4-(Pyrimidin-2-yloxy)-benzaldehyde
  • BAS 08768145
  • 4-(Pyrimidin-2-yloxy)benzaldehyde
  • 4PBL-P26-0
  • MLS000719163
  • SMR000291431

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical 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
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis cytoplasmic intermediate filament protein 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
Candida albicans 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
Echinococcus granulosus intermediate filament protein 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 japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni 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
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 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
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
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
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lamin 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
Schistosoma japonicum expressed 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
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 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 cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K07611 lamin, putative 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
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus 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
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi 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
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
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
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
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 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0065 0.0417 0.0373
Loa Loa (eye worm) TKL/RAF/RAF protein kinase 0.0146 0.1125 0.113
Loa Loa (eye worm) raf kinase 0.0265 0.2169 0.2179
Echinococcus multilocularis protein kinase c eta type 0.0018 0.0004 0.0004
Loa Loa (eye worm) CMGC/MAPK/JNK protein kinase 0.0279 0.2285 0.2296
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Echinococcus multilocularis mitogen activated protein kinase 11 0.0154 0.1197 0.1197
Brugia malayi MAP kinase sur-1 0.0065 0.0417 0.0417
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0065 0.0417 0.0118
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.0154 0.1197 1
Echinococcus multilocularis raf serine:threonine protein kinase 0.0267 0.218 0.218
Brugia malayi Protein kinase c protein 2 0.0023 0.0048 0.0048
Echinococcus multilocularis mitogen activated protein kinase 11 0.0154 0.1197 0.1197
Schistosoma mansoni serine/threonine protein kinase 0.0267 0.218 0.218
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0488 0.5
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.116 1 1
Brugia malayi diacylglycerol kinase 0.0018 0.0004 0.0004
Schistosoma mansoni unc-13 (munc13) 0.0018 0.0004 0.0004
Brugia malayi Protein kinase domain containing protein 0.0023 0.0048 0.0048
Entamoeba histolytica diacylglycerol kinase, putative 0.0018 0.0004 0.0098
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0132 0.0132
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0048 0.0048
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.8419 0.8419
Echinococcus multilocularis mitogen activated protein kinase 0.0065 0.0417 0.0417
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0065 0.0417 0.0373
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0488 0.1258
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0132 0.0132
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0065 0.0417 0.0118
Schistosoma mansoni lamin 0.0033 0.0132 0.0132
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0417 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0065 0.0417 0.0417
Brugia malayi diacylglycerol kinase 0.0018 0.0004 0.0004
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0164 0.1283 0.1289
Schistosoma mansoni hypothetical protein 0.0058 0.0356 0.0356
Echinococcus multilocularis lamin dm0 0.0033 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Echinococcus granulosus protein kinase c epsilon type 0.0035 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0182 0.1436 0.1443
Onchocerca volvulus 0.0062 0.0387 0.2992
Loa Loa (eye worm) hypothetical protein 0.0033 0.0132 0.0132
Trypanosoma brucei protein kinase, putative 0.0062 0.0387 0.3229
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Schistosoma mansoni diacylglycerol kinase theta 0.0018 0.0004 0.0004
Echinococcus multilocularis mitogen activated protein kinase 3 0.0065 0.0417 0.0417
Echinococcus multilocularis mitogen activated protein kinase 14 0.0154 0.1197 0.1197
Schistosoma mansoni rac gtpase activating protein 0.0018 0.0004 0.0004
Echinococcus granulosus mitogen activated protein kinase 0.0065 0.0417 0.0417
Onchocerca volvulus 0.0058 0.0356 0.2757
Echinococcus multilocularis mitogen activated protein kinase 14 0.0154 0.1197 0.1197
Brugia malayi P38 map kinase family protein 2 0.0154 0.1197 0.1197
Loa Loa (eye worm) hypothetical protein 0.1155 0.9955 1
Echinococcus granulosus protein kinase shaggy 0.0062 0.0387 0.0387
Entamoeba histolytica protein kinase domain containing protein 0.0062 0.0387 1
Brugia malayi Raf kinase 0.0249 0.2023 0.2023
Echinococcus granulosus mitogen activated protein kinase 14 0.0154 0.1197 0.1197
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.116 1 1
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0154 0.1197 0.3175
Brugia malayi Pleckstrin Homology Domain 0.0018 0.0004 0.0004
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0488 0.0488
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0062 0.0387 0.0388
Loa Loa (eye worm) hypothetical protein 0.0164 0.1283 0.1289
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Echinococcus multilocularis musashi 0.0033 0.0132 0.0132
Schistosoma mansoni diacylglycerol kinase theta 0.0018 0.0004 0.0004
Schistosoma mansoni protein kinase 0.116 1 1
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0353 0.294 1
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0065 0.0417 0.0118
Schistosoma mansoni protein kinase C mu 0.0018 0.0004 0.0004
Schistosoma mansoni protein kinase 0.116 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0279 0.2285 0.2285
Echinococcus multilocularis Rac GTPase activating protein 1 0.0018 0.0004 0.0004
Echinococcus multilocularis lamin 0.0033 0.0132 0.0132
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0023 0.0048 0.0048
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0353 0.294 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0356 0.0356
Brugia malayi intracellular kinase 0.0062 0.0387 0.0387
Echinococcus granulosus N chimaerin 0.0018 0.0004 0.0004
Echinococcus multilocularis unc 13 (munc13) 0.0018 0.0004 0.0004
Brugia malayi RhoGAP domain containing protein 0.0018 0.0004 0.0004
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0488 0.5
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0018 0.0004 0.0004
Schistosoma mansoni hypothetical protein 0.0205 0.1638 0.1638
Echinococcus granulosus intermediate filament protein 0.0033 0.0132 0.0132
Onchocerca volvulus 0.0033 0.0132 0.0999
Loa Loa (eye worm) RasGEF domain-containing protein 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0032 0.0126 0.0127
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0065 0.0417 0.8531
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0144 0.111 0.111
Echinococcus granulosus raf serine:threonine protein kinase 0.0267 0.218 0.218
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0062 0.0387 0.0387
Brugia malayi RhoGAP domain containing protein 0.0018 0.0004 0.0004
Echinococcus granulosus c-Jun N-terminal kinases 0.0279 0.2285 0.2285
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0018 0.0004 0.0004
Schistosoma mansoni protein kinase C mu 0.0023 0.0048 0.0048
Loa Loa (eye worm) hypothetical protein 0.0348 0.2895 0.2908
Echinococcus multilocularis geminin 0.0205 0.1638 0.1638
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0035 0.0157 0.0157
Schistosoma mansoni lamin 0.0033 0.0132 0.0132
Brugia malayi hypothetical protein 0.0286 0.2346 0.2346
Onchocerca volvulus 0.0033 0.0132 0.0999
Brugia malayi Ras association domain family 1 isoform A 0.0018 0.0004 0.0004
Echinococcus granulosus protein kinase c iota type 0.0035 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0018 0.0004 0.0004
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0062 0.0387 0.0387
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0488 0.5
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0417 1
Echinococcus granulosus geminin 0.0205 0.1638 0.1638
Schistosoma mansoni unc-13 (munc13) 0.0018 0.0004 0.0004
Echinococcus multilocularis N chimaerin 0.0018 0.0004 0.0004
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0018 0.0004 0.0004
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.0154 0.1197 1
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0048 0.0048
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0157 0.0157
Schistosoma mansoni intermediate filament proteins 0.0033 0.0132 0.0132
Echinococcus multilocularis protein kinase c iota type 0.0035 0.0157 0.0157
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0062 0.0387 0.7913
Echinococcus granulosus Rac GTPase activating protein 1 0.0018 0.0004 0.0004
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0062 0.0387 0.0387
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.0154 0.1197 0.1202
Schistosoma mansoni protein kinase C 0.0018 0.0004 0.0004
Entamoeba histolytica diacylglycerol kinase, putative 0.0018 0.0004 0.0098
Loa Loa (eye worm) hypothetical protein 0.0286 0.2346 0.2357
Echinococcus granulosus lamin 0.0033 0.0132 0.0132
Schistosoma mansoni hypothetical protein 0.0205 0.1638 0.1638
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0387 0.9275
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.2346 0.2346
Entamoeba histolytica protein kinase domain containing protein 0.0062 0.0387 1
Echinococcus granulosus lamin dm0 0.0033 0.0132 0.0132
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0164 0.1283 0.1289
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0488 1
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0065 0.0417 0.0118
Echinococcus granulosus unc 13 munc13 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Plasmodium vivax glycogen synthase kinase 3, putative 0.0062 0.0387 0.5
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.2346 0.2346
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0062 0.0387 0.0388
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0018 0.0004 0.0004
Brugia malayi C1-like domain containing protein 0.0023 0.0048 0.0048
Brugia malayi protein kinase C II. 0.0035 0.0157 0.0157
Schistosoma mansoni vav2 0.0018 0.0004 0.0004
Brugia malayi RhoGEF domain containing protein 0.0018 0.0004 0.0004
Entamoeba histolytica hypothetical protein 0.0018 0.0004 0.0098
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0018 0.0004 0.0004
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0488 0.0488
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0417 1
Brugia malayi Variant SH3 domain containing protein 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0154 0.1197 0.3175
Entamoeba histolytica protein kinase, putative 0.0062 0.0387 1
Echinococcus multilocularis myotubularin protein 13 0.0018 0.0004 0.0004
Schistosoma mansoni atypical protein kinase C 0.0035 0.0157 0.0157
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0023 0.0048 0.0049
Giardia lamblia Kinase, CMGC MAPK 0.0065 0.0417 1
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0065 0.0417 0.3481
Brugia malayi intermediate filament protein 0.0033 0.0132 0.0132
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0023 0.0048 0.0048
Echinococcus granulosus Diacylglycerol kinase theta 0.0018 0.0004 0.0004
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0065 0.0417 0.0419
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0488 0.0488
Echinococcus multilocularis Diacylglycerol kinase theta 0.0018 0.0004 0.0004
Echinococcus multilocularis protein kinase c epsilon type 0.0035 0.0157 0.0157
Echinococcus granulosus myotubularin protein 13 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0182 0.144 0.1447
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0018 0.0004 0.0004
Echinococcus multilocularis c Jun NH2 terminal kinase 0.0279 0.2285 0.2285
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0023 0.0048 0.0048
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0144 0.111 0.1115
Echinococcus granulosus Protein kinase C brain isozyme 0.0035 0.0157 0.0157
Schistosoma mansoni hypothetical protein 0.0018 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0488 0.0488
Trichomonas vaginalis CMGC family protein kinase 0.0062 0.0387 0.9275
Brugia malayi Stress-activated protein kinase jnk-1 0.0279 0.2285 0.2285
Loa Loa (eye worm) STE/STE11/ASK protein kinase 0.0353 0.294 0.2953
Schistosoma mansoni survival motor neuron protein 0.0058 0.0356 0.0356
Echinococcus granulosus protein kinase c eta type 0.0018 0.0004 0.0004
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0144 0.111 0.111
Trypanosoma brucei protein kinase, putative 0.0065 0.0417 0.3481
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0488 0.5
Plasmodium falciparum glycogen synthase kinase 3 0.0062 0.0387 0.5
Onchocerca volvulus 0.0164 0.1283 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0157 0.0157
Brugia malayi protein kinase C3,putative 0.0023 0.0048 0.0048
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0023 0.0048 0.0049
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0004
Schistosoma mansoni serine/threonine protein kinase 0.0065 0.0417 0.0417
Echinococcus granulosus mitogen activated protein kinase 11 0.0154 0.1197 0.1197
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0035 0.0157 0.0158
Trichomonas vaginalis CMGC family protein kinase 0.0065 0.0417 1
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0018 0.0004 0.0004
Echinococcus multilocularis protein kinase shaggy 0.0062 0.0387 0.0387
Toxoplasma gondii diacylglycerol kinase, putative 0.0018 0.0004 0.0078

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.004 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.0045 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 1.1689 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 5.1714 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) 8.2753 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) = 12.5893 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) 18.3564 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) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

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