Detailed information for compound 683629

Basic information

Technical information
  • TDR Targets ID: 683629
  • Name: 6-[(4-fluorophenyl)methyl]-3-(prop-2-enylamin o)-2H-1,2,4-triazin-5-one
  • MW: 260.267 | Formula: C13H13FN4O
  • H donors: 2 H acceptors: 4 LogP: 2.19 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=CCNc1nnc(c(n1)O)Cc1ccc(cc1)F
  • InChi: 1S/C13H13FN4O/c1-2-7-15-13-16-12(19)11(17-18-13)8-9-3-5-10(14)6-4-9/h2-6H,1,7-8H2,(H2,15,16,18,19)
  • InChiKey: ARCICKILUPONRD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(allylamino)-6-[(4-fluorophenyl)methyl]-2H-1,2,4-triazin-5-one
  • 3-(allylamino)-6-(4-fluorobenzyl)-2H-1,2,4-triazin-5-one
  • ZINC05154551

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Entamoeba histolytica peptidase, C54 family 0.0024 0.0085 0.0444
Loa Loa (eye worm) glutaminase 2 0.0307 0.2464 0.6686
Schistosoma mansoni serine/threonine protein kinase 0.011 0.0807 0.0807
Schistosoma mansoni tar DNA-binding protein 0.0061 0.04 0.04
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0143 0.1082 0.2951
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0051 0.002
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0068 0.0068
Entamoeba histolytica serine/threonine protein kinase, putative 0.011 0.0807 1
Loa Loa (eye worm) hypothetical protein 0.0095 0.0683 0.1804
Echinococcus granulosus Peptidase C54 0.0061 0.0397 0.0373
Loa Loa (eye worm) hypothetical protein 0.004 0.0224 0.0546
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0037 0.0193 0.1878
Schistosoma mansoni tar DNA-binding protein 0.0061 0.04 0.04
Echinococcus granulosus neuropeptide receptor A26 0.0453 0.3681 0.3665
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Brugia malayi RNA binding protein 0.0061 0.04 0.109
Brugia malayi Heterochromatin protein 1 0.0072 0.0489 0.1334
Schistosoma mansoni alpha-glucosidase 0.0138 0.1045 0.1045
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0139 0.1055 0.1033
Onchocerca volvulus Phospholipase A2 homolog 0.0452 0.3672 1
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0061 0.0397 0.1384
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0139 0.1055 0.1033
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0037 0.0193 0.0569
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0068 0.0132
Echinococcus multilocularis neuropeptide receptor A26 0.0453 0.3681 0.3665
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0061 0.0397 0.1384
Schistosoma mansoni transcription factor LCR-F1 0.004 0.0225 0.0225
Schistosoma mansoni chromobox protein 0.0072 0.0489 0.0489
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0061 0.0397 0.1448
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0026 0.0105 0.0081
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0342 0.1221
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0068 0.0065
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.011 0.0807 0.0784
Schistosoma mansoni hypothetical protein 0.0308 0.2471 0.2471
Schistosoma mansoni ap endonuclease 0.002 0.0051 0.0051
Schistosoma mansoni cpg binding protein 0.009 0.0636 0.0636
Mycobacterium ulcerans glutaminase 0.0307 0.2464 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0051 0.5
Loa Loa (eye worm) glutaminase 0.0307 0.2464 0.6686
Echinococcus multilocularis chromobox protein 1 0.0072 0.0489 0.0466
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Leishmania major alpha glucosidase II subunit, putative 0.0036 0.0185 0.0534
Echinococcus multilocularis GPCR, family 2 0.0143 0.1082 0.106
Schistosoma mansoni kinase 0.0056 0.0354 0.0354
Brugia malayi Calcitonin receptor-like protein seb-1 0.0451 0.3668 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0068 0.0065
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.0225 0.0201
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0068 0.0065
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.0185 0.0438
Trichomonas vaginalis chromobox protein, putative 0.0072 0.0489 0.1832
Trypanosoma brucei polo-like protein kinase 0.011 0.0807 0.3137
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0051 0.5
Echinococcus granulosus cysteine protease atg4b 0.0061 0.0397 0.0373
Echinococcus granulosus geminin 0.0832 0.6858 0.685
Leishmania major DNA polymerase kappa, putative 0.0022 0.0068 0.0065
Giardia lamblia DINP protein human, muc B family 0.0022 0.0068 0.0216
Brugia malayi Peptidase family C54 containing protein 0.0061 0.0397 0.1082
Trypanosoma brucei cysteine peptidase, Clan CA, family C54, putative 0.0024 0.0085 0.0291
Schistosoma mansoni tar DNA-binding protein 0.0061 0.04 0.04
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.1055 0.1055
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative 0.0061 0.0397 0.152
Schistosoma mansoni autophagin-1 (C54 family) 0.0061 0.0397 0.0397
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0017 0.0025 0.0025
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0037 0.0193 0.0718
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Trypanosoma brucei glucosidase, putative 0.0036 0.0185 0.0684
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.026 0.0835
Echinococcus granulosus dna polymerase kappa 0.0022 0.0068 0.0043
Brugia malayi CHD4 protein 0.0017 0.0025 0.0068
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0021 0.0062 0.0037
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0317 0.2547 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0185 0.1765
Schistosoma mansoni chromobox protein 0.0072 0.0489 0.0489
Schistosoma mansoni rotamase 0.0038 0.0201 0.0201
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.015 0.1145 0.4383
Echinococcus granulosus tar DNA binding protein 0.0061 0.04 0.0376
Toxoplasma gondii hypothetical protein 0.0051 0.0315 0.2233
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0068 0.0068
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0068 0.0223
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Onchocerca volvulus 0.0093 0.0665 0.1811
Mycobacterium ulcerans hypothetical protein 0.0167 0.1287 0.5124
Brugia malayi glutaminase DH11.1 0.0307 0.2464 0.6718
Loa Loa (eye worm) hypothetical protein 0.0022 0.0068 0.0117
Entamoeba histolytica peptidase, C54 family 0.0061 0.0397 0.4571
Onchocerca volvulus 0.0032 0.0151 0.0411
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Brugia malayi CXXC zinc finger family protein 0.0085 0.0596 0.1625
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0068 0.0185
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.1055 0.1055
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0161 0.1233 0.3312
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.0807 0.3027
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0185 0.0571
Schistosoma mansoni hypothetical protein 0.0143 0.1082 0.1082
Echinococcus granulosus chromobox protein 1 0.0072 0.0489 0.0466
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0061 0.0397 0.1448
Brugia malayi Phospholipase A2 family protein 0.0095 0.0683 0.1862
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0451 0.3668 1
Schistosoma mansoni alpha glucosidase 0.0036 0.0185 0.0185
Loa Loa (eye worm) RNA binding protein 0.0061 0.04 0.1028
Schistosoma mansoni cpg binding protein 0.009 0.0636 0.0636
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0051 0.0026
Echinococcus granulosus expressed protein 0.0038 0.0201 0.0176
Echinococcus multilocularis neuropeptide s receptor 0.0453 0.3681 0.3665
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0051 0.014
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0317 0.2547 1
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.0807 0.3027
Entamoeba histolytica peptidase, C54 family 0.0024 0.0085 0.0444
Schistosoma mansoni mixed-lineage leukemia protein mll 0.018 0.1392 0.1392
Loa Loa (eye worm) hypothetical protein 0.0032 0.0151 0.0345
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0051 0.5
Onchocerca volvulus Phospholipase A2 homolog 0.0095 0.0683 0.186
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.0185 0.113
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0185 0.0571
Loa Loa (eye worm) latrophilin receptor protein 2 0.0143 0.1082 0.2899
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0021 0.0062 0.0037
Leishmania major DNA polymerase eta, putative 0.0022 0.0068 0.0065
Leishmania major mitochondrial DNA polymerase beta 0.0317 0.2547 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0185 0.1765
Onchocerca volvulus Heterochromatin protein 1 homolog 0.004 0.0224 0.061
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0038 0.0201 0.0547
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0068 0.0068
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0051 0.0026
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0068 0.0185
Brugia malayi TAR-binding protein 0.0061 0.04 0.109
Trichomonas vaginalis chromobox protein, putative 0.0072 0.0489 0.1832
Brugia malayi serine/threonine-protein kinase plk-2 0.011 0.0807 0.22
Brugia malayi chromobox protein homolog 3 0.004 0.0224 0.0611
Loa Loa (eye worm) hypothetical protein 0.0061 0.0397 0.1019
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0068 0.0065
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0021 0.0062 0.0062
Schistosoma mansoni ap endonuclease 0.002 0.0051 0.0051
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0068 0.0117
Trichomonas vaginalis rotamase, putative 0.0037 0.0193 0.0607
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0068 0.0043
Echinococcus granulosus GPCR family 2 0.0143 0.1082 0.106
Entamoeba histolytica hypothetical protein 0.004 0.0225 0.2298
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0037 0.0193 0.0569
Toxoplasma gondii peptidylprolyl isomerase 0.0037 0.0193 0.1203
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0068 0.0065
Echinococcus granulosus cpg binding protein 0.009 0.0636 0.0613
Brugia malayi latrophilin 2 splice variant baaae 0.0308 0.2471 0.6737
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0068 0.0223
Loa Loa (eye worm) hypothetical protein 0.0452 0.3672 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0021 0.0062 0.0037
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0185 0.0571
Echinococcus granulosus dna polymerase eta 0.0022 0.0068 0.0043
Brugia malayi Glycosyl hydrolases family 31 protein 0.0161 0.1233 0.3362
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0185 0.0571
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0139 0.1055 0.1033
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0024 0.0085 0.0134
Echinococcus multilocularis chromobox protein 1 0.0072 0.0489 0.0466
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0068 0.0043
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0143 0.1082 0.106
Echinococcus multilocularis cysteine protease atg4b 0.0061 0.0397 0.0373
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0061 0.0397 0.0397
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0185 0.0534
Trichomonas vaginalis maltase-glucoamylase, putative 0.0036 0.0185 0.0571
Toxoplasma gondii histone lysine methyltransferase SET1 0.016 0.1231 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.0068 0.0087
Schistosoma mansoni hypothetical protein 0.0143 0.1082 0.1082
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0031 0.0145 0.0409
Entamoeba histolytica peptidase, C54 family 0.0024 0.0085 0.0444
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0143 0.1082 0.106
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0061 0.0397 0.1448
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Schistosoma mansoni DNA polymerase eta 0.0022 0.0068 0.0068
Trypanosoma cruzi cysteine peptidase, Clan CA, family C54, putative 0.0024 0.0085 0.0134
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0026 0.0105 0.0081
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0071 0.01
Schistosoma mansoni tar DNA-binding protein 0.0061 0.04 0.04
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0051 0.0159
Schistosoma mansoni hypothetical protein 0.1206 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0139 0.1055 0.2877
Loa Loa (eye worm) hypothetical protein 0.0308 0.2471 0.6706
Entamoeba histolytica hypothetical protein 0.004 0.0225 0.2298
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.0185 0.016
Schistosoma mansoni hypothetical protein 0.0143 0.1082 0.1082
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0185 0.0571
Schistosoma mansoni hypothetical protein 0.0832 0.6858 0.6858
Schistosoma mansoni cpg binding protein 0.0085 0.0596 0.0596
Schistosoma mansoni hypothetical protein 0.0143 0.1082 0.1082
Entamoeba histolytica hypothetical protein 0.004 0.0225 0.2298
Toxoplasma gondii autophagy-related cysteine peptidase atg4, putative 0.0024 0.0085 0.0284
Echinococcus multilocularis tar DNA binding protein 0.0061 0.04 0.0376
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0068 0.0043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.1055 0.1055
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0061 0.0397 0.0397
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0224 0.0734
Schistosoma mansoni tar DNA-binding protein 0.0061 0.04 0.04
Echinococcus multilocularis Peptidase C54 0.0061 0.0397 0.0373
Trichomonas vaginalis chromobox protein, putative 0.0043 0.025 0.0841
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.04 0.1028
Echinococcus granulosus serine:threonine protein kinase PLK1 0.011 0.0807 0.0784
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.011 0.0807 0.2143
Schistosoma mansoni alpha-glucosidase 0.0138 0.1045 0.1045
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.011 0.0807 0.3027
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0139 0.1055 0.1033
Trichomonas vaginalis glutaminase, putative 0.0307 0.2464 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0185 0.0571
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0317 0.2547 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0185 0.0534
Trichomonas vaginalis chromobox protein, putative 0.0043 0.025 0.0841
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0031 0.0145 0.0409
Mycobacterium tuberculosis Conserved hypothetical protein 0.0167 0.1287 1
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0068 0.0065
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.026 0.0835
Loa Loa (eye worm) hypothetical protein 0.0143 0.1082 0.2899
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0201 0.0638
Schistosoma mansoni hypothetical protein 0.0832 0.6858 0.6858
Echinococcus granulosus neuropeptide s receptor 0.0453 0.3681 0.3665
Entamoeba histolytica hypothetical protein 0.004 0.0225 0.2298
Brugia malayi Latrophilin receptor protein 2 0.0143 0.1082 0.2951
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0068 0.0223
Echinococcus multilocularis cpg binding protein 0.009 0.0636 0.0613
Echinococcus multilocularis dnaJ subfamily B 0.1206 1 1
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0037 0.0193 0.0569
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0045 0.026 0.0981
Echinococcus multilocularis lysosomal alpha glucosidase 0.0161 0.1233 0.1211
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0021 0.0059 0.0052
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0061 0.0397 0.1448
Plasmodium falciparum cysteine protease ATG4, putative 0.0024 0.0085 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0068 0.0068
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.025 0.068
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.015 0.1145 0.4383
Brugia malayi F/Y-rich N-terminus family protein 0.0026 0.0103 0.028
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0451 0.3668 0.9987
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Loa Loa (eye worm) CXXC zinc finger family protein 0.0085 0.0596 0.1565
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0068 0.0132
Entamoeba histolytica deoxycytidyl transferase, putative 0.0022 0.0068 0.0216
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0068 0.0223
Loa Loa (eye worm) histone methyltransferase 0.0026 0.0105 0.0221
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0139 0.1055 0.2825
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.0185 0.0504
Echinococcus granulosus lysosomal alpha glucosidase 0.0161 0.1233 0.1211
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0022 0.0071 0.01
Onchocerca volvulus 0.0085 0.0596 0.1623
Echinococcus multilocularis dna polymerase eta 0.0022 0.0068 0.0043
Onchocerca volvulus Serine\/threonine kinase homolog 0.011 0.0807 0.2197
Schistosoma mansoni glutaminase 0.0307 0.2464 0.2464
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0051 0.002
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0342 0.1221
Echinococcus multilocularis expressed protein 0.0038 0.0201 0.0176
Brugia malayi hypothetical protein 0.004 0.0225 0.0613
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0185 0.0571
Trichomonas vaginalis sucrase-isomaltase, putative 0.0036 0.0185 0.0571
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0143 0.1082 0.106
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.092 0.2454
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0031 0.0145 0.0409
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Echinococcus granulosus mixed lineage leukemia protein mll 0.0021 0.0062 0.0037
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.0068 0.0087
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0125 0.0325
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.0342 0.1163
Echinococcus multilocularis geminin 0.0832 0.6858 0.685
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.092 0.2454
Giardia lamblia Kinase, PLK 0.011 0.0807 1
Loa Loa (eye worm) heterochromatin protein 1 0.0072 0.0489 0.1273
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0038 0.0201 0.0482
Loa Loa (eye worm) TAR-binding protein 0.0061 0.04 0.1028
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0061 0.0397 0.1448
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0024 0.0085 0.0134
Trichomonas vaginalis rotamase, putative 0.0038 0.0201 0.0638
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0143 0.1082 0.106
Echinococcus multilocularis lysosomal alpha glucosidase 0.0161 0.1233 0.1211
Schistosoma mansoni hypothetical protein 0.004 0.0225 0.0225
Trichomonas vaginalis CAMK family protein kinase 0.011 0.0807 0.3145
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0224 0.0734
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.0225 0.0201
Echinococcus granulosus chromobox protein 1 0.0072 0.0489 0.0466
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0045 0.026 0.0835
Trypanosoma brucei unspecified product 0.0022 0.0068 0.0223
Entamoeba histolytica peptidase, C54 family 0.0024 0.0085 0.0444
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0068 0.0223
Brugia malayi MH2 domain containing protein 0.0123 0.092 0.2509
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0125 0.0325
Loa Loa (eye worm) hypothetical protein 0.0451 0.3668 0.9987
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.0185 0.016
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.015 0.1145 0.4472
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0051 0.0072
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.04 0.109

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.0119 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
Potency (functional) 10.4179 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 Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ] ChEMBL. No reference
Potency (functional) 100 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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