Detailed information for compound 1232809

Basic information

Technical information
  • TDR Targets ID: 1232809
  • Name: (2R)-2-[4-[(2-bromo-4-nitrophenoxy)methyl]tri azol-1-yl]-2-phenylethanol
  • MW: 419.229 | Formula: C17H15BrN4O4
  • H donors: 1 H acceptors: 5 LogP: 2.66 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H](n1nnc(c1)COc1ccc(cc1Br)[N+](=O)[O-])c1ccccc1
  • InChi: 1S/C17H15BrN4O4/c18-15-8-14(22(24)25)6-7-17(15)26-11-13-9-21(20-19-13)16(10-23)12-4-2-1-3-5-12/h1-9,16,23H,10-11H2/t16-/m0/s1
  • InChiKey: WYUCFYDHCDGNJM-INIZCTEOSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2R)-2-[4-[(2-bromo-4-nitro-phenoxy)methyl]triazol-1-yl]-2-phenyl-ethanol
  • (2R)-2-[4-[(2-bromo-4-nitrophenoxy)methyl]-1-triazolyl]-2-phenylethanol
  • (2R)-2-[4-[(2-bromo-4-nitro-phenoxy)methyl]-1,2,3-triazol-1-yl]-2-phenyl-ethanol

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Onchocerca volvulus 0.0015 0.0173 0.5
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0032 0.057 0.2553
Plasmodium falciparum calcium-dependent protein kinase 1 0.0032 0.057 0.057
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0555 0.067
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0364 0.0439
Mycobacterium tuberculosis Conserved hypothetical protein 0.0023 0.0364 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0555 0.2486
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0364 0.9812
Toxoplasma gondii transporter, major facilitator family protein 0.0015 0.0173 0.0262
Brugia malayi Sugar transporter family protein 0.0106 0.2231 1
Onchocerca volvulus 0.0015 0.0173 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.02 0.297
Schistosoma mansoni protein kinase 0.0032 0.057 0.0688
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0371 0.0448
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0364 0.54
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0037 0.0674 0.102
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0579 0.1973
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0021 0.0305 0.0641
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.02 0.297
Trypanosoma brucei unspecified product 0.0016 0.02 0.297
Entamoeba histolytica protein kinase, putative 0.0032 0.057 0.2805
Brugia malayi hypothetical protein 0.0015 0.0173 0.0775
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0024 0.0371 0.3046
Plasmodium falciparum calcium-dependent protein kinase 3 0.0032 0.057 0.057
Plasmodium falciparum calcium-dependent protein kinase 2 0.0032 0.057 0.057
Loa Loa (eye worm) hypothetical protein 0.0026 0.042 0.1882
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0579 0.8593
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0173 0.0775
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.02 0.297
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0173 0.0775
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0171 0.3706 0.5613
Plasmodium vivax sugar transporter, putative 0.0015 0.0173 0.0173
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0015 0.0173 0.4665
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0106 0.2231 0.2196
Onchocerca volvulus 0.0015 0.0173 0.5
Leishmania major DNA polymerase eta, putative 0.0023 0.0364 0.54
Plasmodium vivax CDK-related protein kinase 6, putative 0.0449 1 1
Onchocerca volvulus 0.0015 0.0173 0.5
Toxoplasma gondii facilitative glucose transporter GT1 0.0106 0.2231 0.3379
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0579 0.8593
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0171 0.3706 0.3706
Toxoplasma gondii sugar transporter ST3 0.0015 0.0173 0.0262
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Onchocerca volvulus 0.0015 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Trypanosoma cruzi glucose transporter, putative 0.0015 0.0173 0.2567
Loa Loa (eye worm) hypothetical protein 0.0024 0.0371 0.1662
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0032 0.0555 0.2486
Brugia malayi major facilitator superfamily protein 0.0015 0.0173 0.0775
Onchocerca volvulus 0.0015 0.0173 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0364 0.0927
Mycobacterium ulcerans sugar transporter 0.0015 0.0173 0.4665
Giardia lamblia Hexose transporter 0.0015 0.0173 0.1576
Toxoplasma gondii protein kinase, putative 0.0299 0.6602 1
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0024 0.0371 0.5503
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0032 0.0555 0.0407
Schistosoma mansoni protein kinase 0.0032 0.057 0.0688
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0032 0.057 0.0423
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0015 0.0173 0.5
Schistosoma mansoni DNA polymerase eta 0.0023 0.0364 0.0439
Schistosoma mansoni glucose transport protein 0.0106 0.2231 0.2694
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0015 0.0173 0.0209
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0579 0.1973
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0364 0.54
Brugia malayi lysyl-tRNA synthetase 0.0024 0.0371 0.1662
Loa Loa (eye worm) sugar transporter 0.0015 0.0173 0.0775
Giardia lamblia Kinesin-5 0.0056 0.1097 1
Plasmodium falciparum calcium-dependent protein kinase 5 0.0032 0.057 0.057
Trypanosoma brucei glucose transporter 2A 0.0033 0.0579 0.8593
Onchocerca volvulus 0.0015 0.0173 0.5
Schistosoma mansoni hypothetical protein 0.0373 0.8282 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Plasmodium falciparum hexose transporter 0.0106 0.2231 0.2231
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0015 0.0173 0.0173
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0371 1
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Giardia lamblia Lysyl-tRNA synthetase 0.0024 0.0371 0.3379
Plasmodium falciparum kinesin-5 0.0056 0.1097 0.1097
Brugia malayi Kinesin motor domain containing protein 0.0056 0.1097 0.4918
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Onchocerca volvulus Putative transporter 0.0015 0.0173 0.5
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0364 0.0204
Trypanosoma brucei sugar transporter, putative 0.0015 0.0173 0.2567
Echinococcus multilocularis General substrate transporter 0.0091 0.1894 0.1837
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0032 0.057 0.8453
Echinococcus multilocularis calcium dependent protein kinase 0.003 0.0524 0.0375
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0015 0.0173 0.4665
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0024 0.0371 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0364 0.54
Onchocerca volvulus 0.0015 0.0173 0.5
Trypanosoma brucei unspecified product 0.0023 0.0364 0.54
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Mycobacterium ulcerans integral membrane transport protein 0.0015 0.0173 0.4665
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.0364 1
Mycobacterium ulcerans prolyl-tRNA synthetase 0.0011 0.009 0.2428
Schistosoma mansoni hypothetical protein 0.0106 0.2231 0.2694
Leishmania major glucose transporter, lmgt2 0.0033 0.0579 0.8593
Plasmodium falciparum protein kinase 7 0.0299 0.6602 0.6602
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Schistosoma mansoni hypothetical protein 0.0205 0.4468 0.5395
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0364 0.1631
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0364 0.54
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.0364 0.9812
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Schistosoma mansoni lysyl-tRNA synthetase 0.0024 0.0371 0.0448
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.002 0.029 0.6143
Plasmodium vivax kinesin-5 0.0056 0.1097 0.1097
Echinococcus granulosus kinesin family 1 0.0429 0.9543 1
Leishmania major protein kinase, putative 0.0032 0.057 0.8453
Leishmania major glucose transporter/membrane transporter D2, putative 0.0033 0.0579 0.8593
Echinococcus multilocularis dna polymerase eta 0.0023 0.0364 0.0204
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0032 0.0555 1
Echinococcus granulosus dna polymerase kappa 0.0023 0.0364 0.0204
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0032 0.0555 0.0407
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0032 0.057 0.0863
Toxoplasma gondii lysine-tRNA ligase 0.0024 0.0371 0.0562
Leishmania major myo-inositol/proton symporter (MIT) 0.0015 0.0173 0.2567
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0032 0.057 0.0863
Brugia malayi Sugar transporter family protein 0.0015 0.0173 0.0775
Leishmania major lysyl-tRNA synthetase, putative 0.0024 0.0371 0.5503
Brugia malayi Cam kinase protein 1 0.0032 0.057 0.2553
Entamoeba histolytica hypothetical protein 0.0024 0.0371 0.0095
Giardia lamblia Prolyl-tRNA synthetase 0.0032 0.0555 0.5055
Leishmania major hypothetical protein, conserved 0.0015 0.0173 0.2567
Trypanosoma brucei myo-inositol/proton symporter (MIT) 0.0015 0.0173 0.2567
Onchocerca volvulus 0.0015 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0037 0.0674 1
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0364 0.54
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0579 0.8593
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0364 0.0927
Brugia malayi Major Facilitator Superfamily protein 0.0015 0.0173 0.0775
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0364 0.1631
Schistosoma mansoni protein kinase 0.0032 0.057 0.0688
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0032 0.057 0.057
Giardia lamblia DINP protein human, muc B family 0.0023 0.0364 0.3316
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0364 0.54
Giardia lamblia Sugar-proton symporter 0.0015 0.0173 0.1576
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Onchocerca volvulus 0.0015 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0032 0.0555 0.2486
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0579 0.1973
Trypanosoma cruzi hexose transporter 0.0033 0.0579 0.8593
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0032 0.057 0.0863
Schistosoma mansoni sugar transporter 0.0015 0.0173 0.0209
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Trichomonas vaginalis CAMK family protein kinase 0.0032 0.057 0.1927
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0674 1
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.002 0.029 0.6143
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Toxoplasma gondii sugar transporter ST2 0.0015 0.0173 0.0262
Entamoeba histolytica kinesin, putative 0.0056 0.1097 1
Schistosoma mansoni sugar transporter 0.0015 0.0173 0.0209
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0013 0.0131 0.0588
Echinococcus granulosus calcium dependent protein kinase 0.003 0.0524 0.0375
Chlamydia trachomatis lysine--tRNA ligase 0.0024 0.0371 1
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0579 0.1973
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0173 0.0775
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.0371 0.0961
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Onchocerca volvulus 0.0015 0.0173 0.5
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0364 0.54
Schistosoma mansoni sugar transporter 0.0015 0.0173 0.0209
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Echinococcus granulosus dna polymerase eta 0.0023 0.0364 0.0204
Trypanosoma brucei glucose transporter 1E 0.0033 0.0579 0.8593
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0032 0.0555 0.1855
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0037 0.0674 1
Loa Loa (eye worm) sugar transporter 0.0106 0.2231 1
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0364 0.0204
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Trypanosoma cruzi hexose transporter, putative 0.0015 0.0173 0.2567
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0364 0.54
Echinococcus granulosus lysyl tRNA synthetase 0.0024 0.0371 0.0211
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0032 0.057 0.057
Brugia malayi Sugar transporter family protein 0.0015 0.0173 0.0775
Onchocerca volvulus 0.0015 0.0173 0.5
Treponema pallidum prolyl-tRNA synthetase 0.0011 0.009 0.5
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0364 0.0204
Toxoplasma gondii sugar transporter ST1 0.0015 0.0173 0.0262
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0032 0.0555 0.2603
Loa Loa (eye worm) hypothetical protein 0.0032 0.057 0.2553
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0674 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0364 0.54
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0032 0.057 0.2553
Plasmodium vivax hexose transporter 0.0106 0.2231 0.2231
Schistosoma mansoni glucose transport protein 0.0106 0.2231 0.2694
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Schistosoma mansoni hypothetical protein 0.0205 0.4468 0.5395
Plasmodium falciparum proline--tRNA ligase 0.0037 0.0674 0.0674
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Trypanosoma cruzi sugar transporter, putative 0.0015 0.0173 0.2567
Leishmania major DNA polymerase kappa, putative 0.0023 0.0364 0.54
Plasmodium vivax calcium-dependent protein kinase, putative 0.0032 0.057 0.057
Schistosoma mansoni serine/threonine protein kinase 0.0032 0.057 0.0688
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0032 0.057 0.057
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0579 0.8593
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0555 0.067
Entamoeba histolytica protein kinase, putative 0.0032 0.057 0.2805
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0032 0.057 0.0423
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0579 0.8593
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Plasmodium vivax lysine--tRNA ligase, putative 0.0024 0.0371 0.0371
Schistosoma mansoni glucose transporter 0.0015 0.0173 0.0209
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0364 0.0439
Echinococcus granulosus General substrate transporter 0.0091 0.1894 0.1837
Onchocerca volvulus 0.0015 0.0173 0.5
Plasmodium falciparum lysine--tRNA ligase 0.0024 0.0371 0.0371
Toxoplasma gondii kinesin motor domain-containing protein 0.0056 0.1097 0.1662
Brugia malayi hypothetical protein 0.0015 0.0173 0.0775
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0364 0.1631
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0032 0.0555 0.2486
Plasmodium falciparum mitogen-activated protein kinase 2 0.0171 0.3706 0.3706
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Echinococcus multilocularis geminin 0.0205 0.4468 0.4584
Echinococcus multilocularis kinesin family 1 0.0429 0.9543 1
Plasmodium vivax proline--tRNA ligase, putative 0.0037 0.0674 0.0674
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0579 0.1973
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0037 0.0674 1
Onchocerca volvulus 0.0015 0.0173 0.5
Onchocerca volvulus 0.0015 0.0173 0.5
Leishmania major glucose transporter, lmgt1 0.0033 0.0579 0.8593
Schistosoma mansoni kinesin eg-5 0.0056 0.1097 0.1325
Echinococcus granulosus geminin 0.0205 0.4468 0.4584
Trichomonas vaginalis conserved hypothetical protein 0.0106 0.2231 1
Loa Loa (eye worm) kinesin-like protein KLP2 0.0056 0.1097 0.4918
Trypanosoma brucei unspecified product 0.0016 0.02 0.297
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Loa Loa (eye worm) major facilitator superfamily transporter 0.0015 0.0173 0.0775
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0364 0.54
Brugia malayi hypothetical protein 0.0015 0.0173 0.0775
Schistosoma mansoni sugar transporter 0.0015 0.0173 0.0209
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0032 0.057 0.2553
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0579 0.1973
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0364 0.54
Onchocerca volvulus 0.0015 0.0173 0.5
Leishmania major glucose transporter, lmgt3 0.0033 0.0579 0.8593
Trypanosoma brucei glucose transporter, putative 0.0033 0.0579 0.8593
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0106 0.2231 0.2196
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0775
Loa Loa (eye worm) hypothetical protein 0.0023 0.0364 0.1631
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0579 0.1973
Plasmodium falciparum calcium-dependent protein kinase 4 0.0032 0.057 0.057
Echinococcus multilocularis lysyl tRNA synthetase 0.0024 0.0371 0.0211
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0579 0.8593
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0242 0.3595
Brugia malayi major facilitator superfamily protein 0.0015 0.0173 0.0775
Schistosoma mansoni glucose transport protein 0.0106 0.2231 0.2694
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0024 0.0371 0.5503

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.2589 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 2.9093 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) 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 (binding) 22.3872 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.