Detailed information for compound 153100

Basic information

Technical information
  • TDR Targets ID: 153100
  • Name: (5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl) b enzoate
  • MW: 286.279 | Formula: C16H14O5
  • H donors: 2 H acceptors: 3 LogP: 2.83 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1cc(O)c2c(c1)OCC(C2)OC(=O)c1ccccc1
  • InChi: 1S/C16H14O5/c17-11-6-14(18)13-8-12(9-20-15(13)7-11)21-16(19)10-4-2-1-3-5-10/h1-7,12,17-18H,8-9H2
  • InChiKey: VVJDVIDJTVHKEI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (5,7-dihydroxychroman-3-yl) benzoate
  • benzoic acid (5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl) ester
  • benzoic acid (5,7-dihydroxychroman-3-yl) ester
  • benzoic acid (5,7-dihydroxy-3-chromanyl) ester
  • AIDS-112310
  • AIDS112310
  • 3,4-Dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl benzoate

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0017 0.0052 0.0052
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0026 0.0153 0.0153
Echinococcus granulosus histone deacetylase 8 0.0099 0.096 0.096
Schistosoma mansoni tyrosine kinase 0.0048 0.0395 0.0395
Leishmania major protein kinase, putative 0.0054 0.0469 0.044
Trypanosoma cruzi histone deacetylase, putative 0.0099 0.096 0.0933
Schistosoma mansoni acetylcholinesterase 0.0054 0.0465 0.0465
Echinococcus granulosus peroxidasin 0.0111 0.1099 0.1098
Echinococcus granulosus tyrosine protein kinase Src64B 0.0036 0.0264 0.0263
Plasmodium vivax unspecified product 0.0916 1 1
Schistosoma mansoni histone deacetylase 4 5 0.0191 0.1977 0.1977
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0043 0.0338 0.0338
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Echinococcus granulosus titin 0.0015 0.0029 0.0028
Schistosoma mansoni nephrin 0.0013 0.0016 0.0015
Brugia malayi Protein kinase domain containing protein 0.0044 0.0357 0.0356
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0054 0.0465 0.0465
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Echinococcus granulosus neuroligin 0.0054 0.0465 0.0465
Brugia malayi histone deacetylase 1 (HD1) 0.021 0.2192 0.2192
Trypanosoma cruzi casein kinase II, putative 0.0916 1 1
Loa Loa (eye worm) histone deacetylase 1 0.021 0.2192 0.2192
Plasmodium falciparum histone deacetylase 2 0.0191 0.1977 0.1953
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0027 0.0164 0.0164
Entamoeba histolytica protein kinase, putative 0.003 0.0197 0.0167
Brugia malayi histone deacetylase 3 (HD3) 0.021 0.2192 0.2192
Loa Loa (eye worm) hypothetical protein 0.0058 0.0512 0.0512
Echinococcus granulosus protein tyrosine kinase 0.0211 0.2205 0.2205
Onchocerca volvulus 0.0054 0.0465 0.3214
Trichomonas vaginalis AGC family protein kinase 0.0026 0.0153 0.0098
Echinococcus multilocularis para nitrobenzyl esterase 0.0054 0.0465 0.0465
Loa Loa (eye worm) histone deacetylase 3 0.021 0.2192 0.2192
Schistosoma mansoni hypothetical protein 0.0023 0.0121 0.0121
Onchocerca volvulus 0.0107 0.105 0.7463
Leishmania major histone deacetylase, putative 0.021 0.2192 0.2169
Loa Loa (eye worm) hypothetical protein 0.0023 0.0121 0.0121
Schistosoma mansoni serine/threonine protein kinase 0.0131 0.1317 0.1317
Loa Loa (eye worm) plexin A 0.0017 0.0052 0.0052
Brugia malayi Protein kinase domain containing protein 0.0198 0.2057 0.2057
Entamoeba histolytica protein kinase, putative 0.0054 0.0469 0.044
Loa Loa (eye worm) hypothetical protein 0.0169 0.1736 0.1736
Schistosoma mansoni hypothetical protein 0.0023 0.0121 0.0121
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0054 0.0469 0.0469
Echinococcus granulosus MAM 0.0023 0.0121 0.0121
Echinococcus granulosus BC026374 protein S09 family 0.0054 0.0465 0.0465
Loa Loa (eye worm) TK protein kinase 0.003 0.0197 0.0197
Echinococcus granulosus histone deacetylase 6 0.0191 0.1977 0.1977
Schistosoma mansoni serine/threonine protein kinase 0.0139 0.1399 0.1399
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0026 0.0149 0.0119
Loa Loa (eye worm) histone deacetylase 7A 0.0191 0.1977 0.1977
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0086 0.0814 0.0786
Echinococcus granulosus insulin receptor 0.0112 0.1106 0.1106
Trypanosoma brucei polo-like protein kinase 0.0086 0.0814 0.0786
Trypanosoma brucei histone deacetylase, putative 0.0191 0.1977 0.1953
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Mycobacterium ulcerans carboxylesterase, LipT 0.0054 0.0465 0.5
Entamoeba histolytica PH domain containing protein kinase, putative 0.0027 0.0168 0.0138
Toxoplasma gondii CMGC kinase, CK2 family 0.0916 1 1
Entamoeba histolytica protein kinase domain containing protein 0.0054 0.0469 0.044
Echinococcus multilocularis histone deacetylase 6 0.0196 0.2033 0.2033
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0026 0.0153 0.0153
Echinococcus granulosus histone deacetylase 1 0.021 0.2192 0.2192
Loa Loa (eye worm) hypothetical protein 0.0111 0.1099 0.1099
Onchocerca volvulus Serine\/threonine kinase homolog 0.0086 0.0814 0.575
Echinococcus multilocularis histone deacetylase 8 0.0099 0.096 0.096
Trypanosoma brucei histone deacetylase 1 0.021 0.2192 0.2169
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0086 0.0814 0.0814
Echinococcus granulosus casein kinase ii subunit alpha 0.0916 1 1
Schistosoma mansoni histone deacetylase 4 5 0.0191 0.1977 0.1977
Entamoeba histolytica serine/threonine protein kinase, putative 0.0086 0.0814 0.0786
Loa Loa (eye worm) hypothetical protein 0.0014 0.0023 0.0023
Schistosoma mansoni serine/threonine protein kinase 0.0015 0.0029 0.0028
Echinococcus granulosus serine/threonine protein kinase 0.0027 0.0168 0.0167
Schistosoma mansoni serine/threonine-protein kinase 0.0027 0.0168 0.0167
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0026 0.0153 0.0153
Echinococcus multilocularis MAM 0.0023 0.0121 0.0121
Onchocerca volvulus 0.0023 0.0121 0.0715
Toxoplasma gondii histone deacetylase HDAC4 0.0241 0.253 0.2508
Echinococcus multilocularis 0.0014 0.0022 0.0021
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Trichomonas vaginalis AGC family protein kinase 0.0054 0.0469 0.0416
Brugia malayi Carboxylesterase family protein 0.0054 0.0465 0.0465
Echinococcus granulosus proto oncogene serine:threonine protein kinase 0.0139 0.1399 0.1399
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0054 0.0469 0.044
Loa Loa (eye worm) CAMK/CAMKL/NUAK protein kinase 0.0406 0.4356 0.4356
Schistosoma mansoni protein kinase 0.0015 0.003 0.003
Brugia malayi Histone deacetylase family protein 0.0191 0.1977 0.1977
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0026 0.0153 0.0153
Schistosoma mansoni tyrosine kinase 0.0112 0.1106 0.1106
Giardia lamblia Kinase, NEK 0.0093 0.0891 0.0753
Schistosoma mansoni protein kinase 0.0916 1 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Loa Loa (eye worm) carboxylesterase 0.0054 0.0465 0.0465
Schistosoma mansoni BC026374 protein (S09 family) 0.0054 0.0465 0.0465
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0054 0.0465 0.0465
Echinococcus granulosus protein kinase c iota type 0.0026 0.0153 0.0153
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0026 0.0153 0.0153
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Brugia malayi serine/threonine kinase 12 0.0054 0.0469 0.0469
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0026 0.0153 0.0153
Loa Loa (eye worm) SRC-1 0.0036 0.0264 0.0264
Loa Loa (eye worm) AUR protein kinase 0.0054 0.0469 0.0469
Echinococcus multilocularis tyrosine protein kinase Srms 0.0033 0.0231 0.023
Echinococcus granulosus serine threonine protein kinase nrc 0.0026 0.0149 0.0149
Echinococcus multilocularis carboxylesterase 5A 0.032 0.3407 0.3407
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Onchocerca volvulus 0.0113 0.1113 0.7923
Brugia malayi plexin A 0.0017 0.0052 0.0051
Echinococcus granulosus NDR protein kinase 0.0026 0.0153 0.0153
Brugia malayi Protein kinase domain containing protein 0.0112 0.1106 0.1106
Brugia malayi Immunoglobulin I-set domain containing protein 0.0015 0.0029 0.0028
Trypanosoma cruzi polo-like protein kinase, putative 0.0086 0.0814 0.0786
Giardia lamblia Histone deacetylase 0.021 0.2192 0.2074
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0054 0.0465 0.0412
Schistosoma mansoni serine/threonine kinase 0.0026 0.0153 0.0153
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0033 0.0231 0.023
Plasmodium falciparum NIMA related kinase 1 0.0093 0.0891 0.0863
Onchocerca volvulus Peroxidasin homolog 0.0109 0.1071 0.7619
Echinococcus multilocularis proto oncogene serine:threonine protein kinase 0.0139 0.1399 0.1399
Brugia malayi hypothetical protein 0.0054 0.0465 0.0465
Schistosoma mansoni cell adhesion molecule 0.0014 0.0022 0.0021
Echinococcus multilocularis tyrosine protein kinase Blk 0.0033 0.0231 0.023
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0036 0.0264 0.0263
Echinococcus multilocularis histone deacetylase 6 0.0191 0.1977 0.1977
Trichomonas vaginalis CAMK family protein kinase 0.0047 0.0384 0.0329
Entamoeba histolytica histone deacetylase, putative 0.021 0.2192 0.2169
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Plasmodium falciparum histone deacetylase, putative 0.0191 0.1977 0.1953
Trypanosoma cruzi aurora B kinase, putative 0.0054 0.0469 0.044
Echinococcus multilocularis serine:threonine protein kinase N2 0.0131 0.1317 0.1317
Schistosoma mansoni tyrosine kinase 0.0048 0.0395 0.0395
Echinococcus granulosus tyrosine protein kinase Src42A 0.0036 0.0264 0.0263
Echinococcus granulosus tyrosine protein kinase HCK 0.003 0.0197 0.0196
Onchocerca volvulus 0.0054 0.0465 0.3214
Loa Loa (eye worm) histone deacetylase 11 0.0241 0.253 0.253
Loa Loa (eye worm) AUR protein kinase 0.0054 0.0469 0.0469
Echinococcus multilocularis histone deacetylase 3 0.021 0.2192 0.2192
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0139 0.1399 0.1399
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0026 0.0153 0.0153
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0036 0.0264 0.0263
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0026 0.0153 0.0153
Chlamydia trachomatis serine/threonine protein kinase 0.0177 0.1825 0.5
Trypanosoma brucei rac serine-threonine kinase, putative 0.0044 0.0357 0.0327
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0054 0.0469 0.0325
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Trichomonas vaginalis AGC family protein kinase 0.0054 0.0469 0.0416
Echinococcus granulosus serine:threonine protein kinase N2 0.0105 0.1031 0.1031
Brugia malayi histone deacetylase 11 0.0241 0.253 0.253
Onchocerca volvulus Chorion peroxidase homolog 0.0107 0.105 0.7463
Loa Loa (eye worm) hypothetical protein 0.0099 0.096 0.096
Echinococcus granulosus tyrosine protein kinase Blk 0.0033 0.0231 0.023
Toxoplasma gondii histone deacetylase HDAC5 0.0099 0.096 0.0933
Loa Loa (eye worm) acetylcholinesterase 1 0.032 0.3407 0.3407
Trichomonas vaginalis spcc417.12 protein, putative 0.0054 0.0465 0.0412
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Schistosoma mansoni plexin 0.0014 0.0023 0.0023
Brugia malayi Blistered cuticle protein 3 0.0107 0.105 0.1049
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0054 0.0469 0.0469
Schistosoma mansoni protein kinase 0.0054 0.0469 0.0469
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Echinococcus granulosus tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Entamoeba histolytica protein kinase, putative 0.0054 0.0469 0.044
Leishmania major histone deacetylase, putative 0.0191 0.1977 0.1953
Loa Loa (eye worm) TK protein kinase 0.0033 0.0231 0.0231
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Onchocerca volvulus 0.0054 0.0465 0.3214
Loa Loa (eye worm) hypothetical protein 0.021 0.2192 0.2192
Brugia malayi serine/threonine-protein kinase plk-2 0.0086 0.0814 0.0814
Echinococcus multilocularis plexin a4 0.0017 0.0052 0.0051
Echinococcus granulosus acetylcholinesterase 0.032 0.3407 0.3407
Trichomonas vaginalis STE family protein kinase 0.0093 0.0891 0.0839
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Echinococcus granulosus histone deacetylase 6 0.0191 0.1977 0.1977
Echinococcus granulosus tyrosine kinase 0.0033 0.0231 0.023
Leishmania major histone deacetylase, putative 0.021 0.2192 0.2169
Echinococcus multilocularis tyrosine protein kinase HCK 0.003 0.0197 0.0196
Brugia malayi hypothetical protein 0.0023 0.0121 0.0121
Loa Loa (eye worm) histone deacetylase 0.0191 0.1977 0.1977
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0054 0.0465 0.5
Loa Loa (eye worm) carboxylesterase 0.0054 0.0465 0.0465
Brugia malayi Animal haem peroxidase family protein 0.0107 0.105 0.1049
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.021 0.2192 0.2149
Echinococcus granulosus protein kinase c epsilon type 0.0026 0.0153 0.0153
Loa Loa (eye worm) TK/FAK protein kinase 0.0214 0.2232 0.2232
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0054 0.0465 0.0465
Brugia malayi Animal haem peroxidase family protein 0.0107 0.105 0.1049
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0054 0.0465 0.0465
Giardia lamblia Kinase, CMGC CK2 0.0916 1 1
Schistosoma mansoni gliotactin 0.0054 0.0465 0.0465
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Echinococcus multilocularis roundabout 2 0.0016 0.0043 0.0043
Brugia malayi Immunoglobulin I-set domain containing protein 0.0129 0.1291 0.129
Schistosoma mansoni peroxidasin 0.0109 0.1077 0.1077
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Echinococcus multilocularis protein tyrosine kinase 0.0211 0.2205 0.2205
Toxoplasma gondii NIMA-related protein kinase NIMA1 0.0093 0.0891 0.0863
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Entamoeba histolytica protein kinase domain containing protein 0.0916 1 1
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0036 0.0264 0.0263
Brugia malayi Furin-like cysteine rich region family protein 0.0054 0.0462 0.0461
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0086 0.0814 0.0814
Echinococcus granulosus Glutaredoxin protein 5 0.0017 0.0052 0.0052
Brugia malayi protein kinase C II. 0.0026 0.0153 0.0153
Trichomonas vaginalis AGC family protein kinase 0.0054 0.0469 0.0416
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0017 0.0052 0.0052
Trichomonas vaginalis AGC family protein kinase 0.0028 0.0172 0.0116
Toxoplasma gondii AGC kinase 0.0043 0.0338 0.0309
Echinococcus multilocularis acetylcholinesterase 0.032 0.3407 0.3407
Loa Loa (eye worm) AGC/PKN protein kinase 0.0131 0.1317 0.1317
Brugia malayi Protein kinase domain containing protein 0.0026 0.0153 0.0153
Brugia malayi serine/threonine-protein kinase 6 0.0054 0.0469 0.0469
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0026 0.0153 0.0153
Echinococcus multilocularis histone deacetylase 1 0.021 0.2192 0.2192
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Brugia malayi protein unc-22 0.0015 0.0029 0.0028
Loa Loa (eye worm) hypothetical protein 0.0023 0.0121 0.0121
Loa Loa (eye worm) hypothetical protein 0.0026 0.0153 0.0153
Loa Loa (eye worm) CMGC/CK2 protein kinase 0.0916 1 1
Giardia lamblia Kinase, PLK 0.0086 0.0814 0.0675
Echinococcus granulosus histone deacetylase 0.0191 0.1977 0.1977
Echinococcus multilocularis serine threonine protein kinase 0.0026 0.0153 0.0153
Schistosoma mansoni kinase 0.0048 0.0395 0.0394
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Trypanosoma cruzi histone deacetylase, putative 0.0191 0.1977 0.1953
Echinococcus granulosus epidermal growth factor receptor 0.0054 0.0462 0.0461
Brugia malayi Carboxylesterase family protein 0.0054 0.0465 0.0465
Trypanosoma cruzi histone deacetylase, putative 0.0191 0.1977 0.1953
Trypanosoma cruzi histone deacetylase 1, putative 0.021 0.2192 0.2169
Echinococcus granulosus tyrosine protein kinase Src42A 0.0027 0.0164 0.0164
Schistosoma mansoni tyrosine kinase 0.0211 0.2205 0.2205
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0026 0.0153 0.0153
Brugia malayi Animal haem peroxidase family protein 0.0107 0.105 0.1049
Plasmodium vivax histone deacetylase, putative 0.0191 0.1977 0.1856
Toxoplasma gondii histone deacetylase HDAC1 0.0191 0.1977 0.1953
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0036 0.0264 0.0263
Echinococcus multilocularis neuroligin 0.0054 0.0465 0.0465
Echinococcus granulosus twitchin 0.0018 0.007 0.0069
Plasmodium vivax NIMA-related protein kinase (Pfnek-1), putative 0.0093 0.0891 0.0753
Brugia malayi Protein kinase domain containing protein 0.0214 0.2232 0.2232
Echinococcus multilocularis peroxidasin 0.0111 0.1099 0.1098
Echinococcus multilocularis aurora kinase A 0.0054 0.0469 0.0469
Onchocerca volvulus 0.0027 0.0165 0.103
Echinococcus multilocularis histone deacetylase 6 0.0191 0.1977 0.1977
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0054 0.0465 0.5
Echinococcus multilocularis serine:threonine protein kinase N2 0.0026 0.0153 0.0153
Brugia malayi Protein kinase domain containing protein 0.0064 0.0578 0.0577
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.032 0.3407 0.3407
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Plasmodium falciparum RAC-beta serine/threonine protein kinase 0.0026 0.0149 0.0119
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0054 0.0465 0.0465
Echinococcus multilocularis epidermal growth factor receptor 0.0054 0.0462 0.0461
Plasmodium falciparum histone deacetylase 1 0.021 0.2192 0.2169
Entamoeba histolytica protein kinase, putative 0.0044 0.0357 0.0327
Loa Loa (eye worm) animal heme peroxidase 0.0107 0.105 0.105
Echinococcus multilocularis activin receptor type 0.0015 0.003 0.003
Onchocerca volvulus Peroxidase homolog 0.0107 0.105 0.7463
Brugia malayi Animal haem peroxidase family protein 0.0109 0.1071 0.1071
Echinococcus multilocularis serine threonine protein kinase nrc serine threonine protein kinase gad 0.0026 0.0149 0.0149
Loa Loa (eye worm) TK/ALK protein kinase 0.0198 0.2057 0.2057
Onchocerca volvulus Dual oxidase homolog 0.0107 0.105 0.7463
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Trichomonas vaginalis AGC family protein kinase 0.0026 0.0153 0.0098
Schistosoma mansoni tyrosine kinase 0.0054 0.0462 0.0461
Echinococcus granulosus nervana 2 0.0017 0.0052 0.0052
Echinococcus granulosus Protein kinase C brain isozyme 0.0026 0.0153 0.0153
Trypanosoma cruzi histone deacetylase, putative 0.0191 0.1977 0.1953
Echinococcus multilocularis rac serine:threonine kinase 0.0027 0.0168 0.0167
Onchocerca volvulus Peroxidasin homolog 0.0109 0.1071 0.7619
Entamoeba histolytica PH domain containing protein kinase, putative 0.0027 0.0168 0.0138
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Echinococcus multilocularis serine:threonine protein kinase N2 0.0105 0.1031 0.1031
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Echinococcus granulosus activin receptor type 0.0015 0.003 0.003
Echinococcus multilocularis histone deacetylase 0.0191 0.1977 0.1977
Echinococcus multilocularis insulin receptor 0.0112 0.1106 0.1106
Schistosoma mansoni tyrosine kinase 0.0036 0.0264 0.0263
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Loa Loa (eye worm) animal heme peroxidase 0.0109 0.1071 0.1071
Toxoplasma gondii histone deacetylase HDAC2 0.021 0.2192 0.2169
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0054 0.0469 0.044
Loa Loa (eye worm) animal heme peroxidase 0.0107 0.105 0.105
Toxoplasma gondii aurora kinase 0.0054 0.0469 0.044
Schistosoma mansoni histone deacetylase 0.021 0.2192 0.2192
Echinococcus granulosus plexin a4 0.0017 0.0052 0.0051
Entamoeba histolytica casein kinase, putative 0.0916 1 1
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Entamoeba histolytica protein kinase, putative 0.0026 0.0153 0.0123
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0026 0.0153 0.0153
Schistosoma mansoni histone deacetylase 0.021 0.2192 0.2192
Loa Loa (eye worm) AGC/NDR protein kinase 0.0026 0.0153 0.0153
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Onchocerca volvulus Histone deacetylase 10 homolog 0.0099 0.096 0.6811
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Trypanosoma cruzi histone deacetylase 1, putative 0.021 0.2192 0.2169
Brugia malayi Histone deacetylase family protein 0.0191 0.1977 0.1977
Onchocerca volvulus 0.0054 0.0465 0.3214
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0036 0.0264 0.0263
Schistosoma mansoni atypical protein kinase C 0.0026 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0086 0.0814 0.0814
Brugia malayi Histone deacetylase 1 0.021 0.2192 0.2192
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0033 0.0231 0.023
Toxoplasma gondii histone deacetylase HDAC3 0.021 0.2192 0.2169
Onchocerca volvulus Serine\/threonine protein kinase homolog 0.0139 0.1399 1
Schistosoma mansoni tyrosine kinase 0.0054 0.0462 0.0461
Echinococcus granulosus tyrosine protein kinase Fyn 0.0036 0.0264 0.0263
Echinococcus granulosus dual specificity testis-specific protein kinase 0.0015 0.003 0.003
Trypanosoma cruzi polo-like protein kinase, putative 0.0086 0.0814 0.0786
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0036 0.0264 0.0263
Onchocerca volvulus 0.0107 0.105 0.7463
Brugia malayi protein-tyrosine kinase 0.0033 0.0231 0.023
Echinococcus granulosus acetylcholinesterase 0.032 0.3407 0.3407
Echinococcus granulosus epidermal growth factor receptor 0.0054 0.0462 0.0461
Loa Loa (eye worm) TK/INSR protein kinase 0.0112 0.1106 0.1106
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.021 0.2192 0.2149
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0027 0.0168 0.0138
Giardia lamblia Aurora kinase 0.0054 0.0469 0.0325
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Echinococcus multilocularis serine:threonine protein kinase 38 0.0026 0.0153 0.0153
Brugia malayi Serine/threonine-protein kinase Nek7 0.0177 0.1825 0.1825
Onchocerca volvulus 0.0054 0.0465 0.3214
Echinococcus granulosus roundabout 2 0.0016 0.0043 0.0043
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0017 0.0056 0.0056
Echinococcus multilocularis dual specificity testis specific protein kinase 0.0015 0.003 0.003
Brugia malayi Carboxylesterase family protein 0.0054 0.0465 0.0465
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Loa Loa (eye worm) hypothetical protein 0.0142 0.1437 0.1437
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Loa Loa (eye worm) carboxylesterase 0.032 0.3407 0.3407
Brugia malayi Plexin repeat family protein 0.0014 0.0023 0.0023
Schistosoma mansoni tyrosine kinase 0.0048 0.0395 0.0395
Schistosoma mansoni neuroligin 3 (S09 family) 0.0054 0.0465 0.0465
Loa Loa (eye worm) thyroid receptor interactor 0.0061 0.0545 0.0545
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0015 0.0029 0.0029
Trypanosoma brucei histone deacetylase 2 0.0099 0.096 0.0933
Brugia malayi Carboxylesterase family protein 0.032 0.3407 0.3407
Echinococcus multilocularis protein kinase c iota type 0.0026 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Echinococcus multilocularis epidermal growth factor receptor 0.0054 0.0462 0.0461
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Brugia malayi Serine/threonine-protein kinase Pim-3 0.0139 0.1399 0.1399
Loa Loa (eye worm) hypothetical protein 0.0092 0.0884 0.0884
Loa Loa (eye worm) hypothetical protein 0.0054 0.0465 0.0465
Entamoeba histolytica protein kinase, putative 0.0043 0.0338 0.0309
Trypanosoma cruzi Protein kinase B 0.0027 0.0168 0.0138
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Trypanosoma brucei Casein kinase II 0.0916 1 1
Loa Loa (eye worm) TK/EGFR protein kinase 0.0054 0.0462 0.0462
Entamoeba histolytica protein kinase, putative 0.0044 0.0357 0.0327
Schistosoma mansoni histone deacetylase hda2 0.0099 0.096 0.096
Trichomonas vaginalis CAMK family protein kinase 0.0047 0.0384 0.0329
Trypanosoma brucei histone deacetylase 4 0.0191 0.1977 0.1953
Brugia malayi Carboxylesterase family protein 0.0054 0.0465 0.0465
Schistosoma mansoni protein kinase 0.0015 0.003 0.003
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0116 0.1149 0.1149
Schistosoma mansoni tyrosine kinase 0.0112 0.1106 0.1106
Loa Loa (eye worm) CAMK protein kinase 0.0015 0.0029 0.0029
Mycobacterium tuberculosis Carboxylesterase LipT 0.0054 0.0465 0.5
Trypanosoma brucei aurora B kinase 0.0054 0.0469 0.044
Trichomonas vaginalis CAMK family protein kinase 0.0086 0.0814 0.0763
Echinococcus multilocularis BC026374 protein (S09 family) 0.0054 0.0465 0.0465
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0036 0.0264 0.0263
Schistosoma mansoni serine/threonine protein kinase 0.0054 0.0469 0.0469
Leishmania major histone deacetylase, putative 0.0191 0.1977 0.1953
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0139 0.1399 0.1399
Echinococcus multilocularis Glutaredoxin protein 5 0.0017 0.0052 0.0052
Loa Loa (eye worm) hypothetical protein 0.032 0.3407 0.3407
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0116 0.1149 0.1149
Plasmodium falciparum serine/threonine protein kinase, putative 0.0054 0.0469 0.044
Echinococcus multilocularis protein kinase c epsilon type 0.0026 0.0153 0.0153
Brugia malayi Protein kinase domain containing protein 0.0026 0.0153 0.0153
Echinococcus granulosus titin 0.0015 0.0029 0.0028
Trichomonas vaginalis AGC family protein kinase 0.0093 0.0891 0.0839
Plasmodium falciparum casein kinase 2, alpha subunit 0.0916 1 1
Echinococcus granulosus para nitrobenzyl esterase 0.0054 0.0465 0.0465
Loa Loa (eye worm) animal heme peroxidase 0.0107 0.105 0.105
Loa Loa (eye worm) blistered cuticle protein 3 0.0107 0.105 0.105
Echinococcus multilocularis titin 0.0015 0.0029 0.0028
Loa Loa (eye worm) NEK/NEK6 protein kinase 0.0177 0.1825 0.1825
Echinococcus multilocularis histone deacetylase 7 0.0191 0.1977 0.1977
Echinococcus granulosus histone deacetylase 7 0.0191 0.1977 0.1977
Trichomonas vaginalis AGC family protein kinase 0.0044 0.0357 0.0302
Echinococcus multilocularis nervana 2 0.0017 0.0052 0.0052
Schistosoma mansoni titin 0.0015 0.0029 0.0028
Echinococcus granulosus nervana 2 0.0017 0.0052 0.0052
Entamoeba histolytica protein kinase , putative 0.0054 0.0469 0.044
Plasmodium vivax casein kinase 2, alpha subunit, putative 0.0916 1 1
Loa Loa (eye worm) AGC/AKT protein kinase 0.0044 0.0357 0.0357
Entamoeba histolytica protein kinase 2, putative 0.0026 0.0149 0.0119
Echinococcus granulosus tyrosine protein kinase Lyn 0.0045 0.0361 0.036
Trypanosoma cruzi histone deacetylase, putative 0.0099 0.096 0.0933
Loa Loa (eye worm) hypothetical protein 0.0097 0.094 0.094
Brugia malayi Peroxidasin 0.0111 0.1099 0.1098
Leishmania major casein kinase II, putative 0.0916 1 1
Brugia malayi Fes/CIP4 homology domain containing protein 0.0061 0.0545 0.0544
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Giardia lamblia Kinase, NEK 0.0093 0.0891 0.0753
Echinococcus granulosus histone deacetylase 3 0.021 0.2192 0.2192
Loa Loa (eye worm) hypothetical protein 0.0023 0.0121 0.0121
Loa Loa (eye worm) AUR protein kinase 0.0054 0.0469 0.0469
Brugia malayi hypothetical protein 0.0107 0.105 0.1049
Loa Loa (eye worm) hypothetical protein 0.032 0.3407 0.3407
Trichomonas vaginalis AGC family protein kinase 0.0026 0.0153 0.0098
Trichomonas vaginalis histone deacetylase, putative 0.021 0.2192 0.2149
Giardia lamblia Kinase, NEK 0.0093 0.0891 0.0753
Brugia malayi Animal haem peroxidase family protein 0.0107 0.105 0.1049
Trichomonas vaginalis CMGC family protein kinase 0.0916 1 1
Onchocerca volvulus 0.0015 0.0029 0.0042
Echinococcus multilocularis acetylcholinesterase 0.032 0.3407 0.3407
Echinococcus granulosus calcium:calmodulin dependent protein kinase 0.0026 0.0149 0.0149
Schistosoma mansoni protein kinase 0.0015 0.003 0.003
Plasmodium vivax histone deacetylase 2, putative 0.0191 0.1977 0.1856
Echinococcus multilocularis nervana 2 0.0017 0.0052 0.0052
Schistosoma mansoni serine/threonine-protein kinase 0.0027 0.0168 0.0167
Onchocerca volvulus 0.0107 0.105 0.7463
Plasmodium vivax histone deacetylase 1, putative 0.021 0.2192 0.2074
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Echinococcus multilocularis casein kinase ii subunit alpha 0.0916 1 1
Onchocerca volvulus Tyrosine kinase homolog 0.0121 0.1201 0.856
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Brugia malayi p70 ribosomal S6 kinase beta 0.0043 0.0338 0.0338
Schistosoma mansoni histone deacetylase 1 2 3 0.0099 0.096 0.096
Brugia malayi serine/threonine protein kinase 6 0.0054 0.0469 0.0469
Onchocerca volvulus Peroxidase homolog 0.0107 0.105 0.7463
Loa Loa (eye worm) hypothetical protein 0.0107 0.105 0.105
Schistosoma mansoni peroxidasin 0.0107 0.105 0.1049
Schistosoma mansoni serine/threonine protein kinase 0.0026 0.0153 0.0153
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0054 0.0462 0.0461
Brugia malayi Hr1 repeat family protein 0.0131 0.1317 0.1317
Trypanosoma brucei histone deacetylase 3 0.0191 0.1977 0.1953
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.021 0.2192 0.2149
Schistosoma mansoni histone deacetylase hda2 0.0196 0.2033 0.2033
Schistosoma mansoni tyrosine kinase 0.0054 0.0462 0.0461
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0054 0.0469 0.044
Echinococcus granulosus carboxylesterase 5A 0.032 0.3407 0.3407
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0036 0.0264 0.0263
Brugia malayi Protein kinase domain containing protein 0.0139 0.1399 0.1399
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0129 0.1291 0.1291
Brugia malayi Carboxylesterase family protein 0.032 0.3407 0.3407
Echinococcus granulosus serine:threonine protein kinase N2 0.0131 0.1317 0.1317
Plasmodium vivax histone deacetylase, putative 0.0241 0.253 0.2417
Echinococcus granulosus protein kinase C gamma type 0.0026 0.0153 0.0153
Trichomonas vaginalis AGC family protein kinase 0.0054 0.0469 0.0416
Schistosoma mansoni serine/threonine protein kinase 0.0177 0.1825 0.1825
Schistosoma mansoni serine/threonine protein kinase 0.0086 0.0814 0.0814
Schistosoma mansoni tyrosine kinase 0.0036 0.0264 0.0263
Echinococcus granulosus histone deacetylase 6 0.0196 0.2033 0.2033
Brugia malayi SRC-1 0.0036 0.0264 0.0263
Echinococcus granulosus aurora kinase A 0.0054 0.0469 0.0469

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 100 uM Inhibition of polymerization in wild type HIV-1 RT with poly rC/dG12-18 template primer and [3H]-dGTP ChEMBL. 11591519
IC50 (binding) > 100 uM Inhibitory concentration of the compound against polymerization in A17 double mutant HIV-1 RT using a template primer of poly rC/dG12-18 and [3H]-dGTP ChEMBL. 11591519
IC50 (binding) > 100 uM Inhibition of HIV-1 reverse transcriptase polymerization using wild type HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase polymerization using A17 double mutant HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase strand transfer using wild type HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase strand transfer using A17 double mutant HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Inhibition of polymerization in wild type HIV-1 RT with poly rC/dG12-18 template primer and [3H]-dGTP ChEMBL. 11591519
IC50 (binding) > 100 uM Inhibitory concentration of the compound against polymerization in A17 double mutant HIV-1 RT using a template primer of poly rC/dG12-18 and [3H]-dGTP ChEMBL. 11591519
IC50 (binding) > 100 uM Inhibition of HIV-1 reverse transcriptase polymerization using wild type HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase polymerization using A17 double mutant HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase strand transfer using wild type HIV-1-RT enzyme ChEMBL. 11844664
IC50 (binding) > 100 uM Tested for its ability to inhibit HIV-1 reverse transcriptase strand transfer using A17 double mutant HIV-1-RT enzyme ChEMBL. 11844664

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

2 literature references were collected for this gene.

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