Detailed information for compound 336487

Basic information

Technical information
  • TDR Targets ID: 336487
  • Name: 9-[(4-fluorophenyl)methyl]-6-(furan-2-yl)puri ne
  • MW: 294.283 | Formula: C16H11FN4O
  • H donors: 0 H acceptors: 3 LogP: 2.51 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)Cn1cnc2c1ncnc2c1ccco1
  • InChi: 1S/C16H11FN4O/c17-12-5-3-11(4-6-12)8-21-10-20-15-14(13-2-1-7-22-13)18-9-19-16(15)21/h1-7,9-10H,8H2
  • InChiKey: ZJWNHKNAMDHZFA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 9-[(4-fluorophenyl)methyl]-6-(2-furyl)purine
  • 9-(4-fluorobenzyl)-6-(2-furyl)purine
  • 9-[(4-fluorophenyl)methyl]-6-furan-2-ylpurine
  • 9-[(4-fluorophenyl)methyl]-6-furan-2-yl-purine
  • 9H-Purine, 9-[(4-fluorophenyl)methyl]-6-(2-furanyl)-
  • AIDS-119261
  • AIDS119261

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
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Loa Loa (eye worm) proprotein convertase 2 0.0146 0.0213 0.0199
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Loa Loa (eye worm) hypothetical protein 0.0146 0.0213 0.0199
Brugia malayi endoprotease bli-4 precursor 0.0146 0.0213 0.0199
Trypanosoma brucei subtilisin peptidase 0.0146 0.0213 0.7155
Leishmania major phosphatidylinositol 3-kinase, putative 0.0091 0.0097 0.4167
Trypanosoma cruzi Protein kinase B 0.0051 0.001 0.009
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0119 0.0157 0.0425
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0835 0.169 0.4589
Trichomonas vaginalis PIKK family atypical protein kinase 0.0053 0.0014 0.0132
Echinococcus granulosus neuroendocrine convertase 2 0.0146 0.0213 0.0579
Brugia malayi Membrane-bound transcription factor site-1 protease precursor 0.0146 0.0213 0.0199
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0413 0.0785 0.7242
Echinococcus granulosus furin 0.0146 0.0213 0.0579
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0413 0.0785 0.7242
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Trichomonas vaginalis PIKK family atypical protein kinase 0.0119 0.0157 0.1444
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.0146 0.0213 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0183 0.0292 0.2696
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0535
Loa Loa (eye worm) subtilase 0.4715 1 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0119 0.0157 0.1445
Trichomonas vaginalis conserved hypothetical protein 0.0146 0.0213 0.1966
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0119 0.0157 0.0142
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0536
Entamoeba histolytica hypothetical protein 0.0461 0.0889 0.8201
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.0146 0.0213 0.5
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0322 0.0591 0.1605
Loa Loa (eye worm) endoprotease bli-4 0.0146 0.0213 0.0199
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0053 0.0014 0.0039
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0091 0.0097 0.0083
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0091 0.0097 0.4563
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Toxoplasma gondii subtilisin SUB5 0.0146 0.0213 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0091 0.0097 0.0898
Plasmodium vivax subtilisin-like protease 1 0.0146 0.0213 1
Loa Loa (eye worm) hypothetical protein 0.023 0.0394 0.038
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0053 0.0014 0.0039
Toxoplasma gondii subtilisin SUB9 0.0146 0.0213 1
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0069 0.005 0.0035
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0183 0.0292 0.2696
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.0146 0.0213 0.5
Brugia malayi proprotein convertase 2 0.0146 0.0213 0.0199
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.0146 0.0213 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0079 0.0071 0.065
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0061 0.0032 0.0616
Trichomonas vaginalis PIKK family atypical protein kinase 0.0105 0.0125 0.1156
Brugia malayi Hypothetical subtilase-type proteinase F21H12.6 in chromosome II 0.0146 0.0213 0.0199
Trichomonas vaginalis PIKK family atypical protein kinase 0.0053 0.0014 0.0132
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0053 0.0014 0.0134
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Entamoeba histolytica protein kinase, putative 0.0069 0.005 0.0459
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.0146 0.0213 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0535
Trichomonas vaginalis PIKK family atypical protein kinase 0.0099 0.0113 0.104
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0548 0.1074 0.2917
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0552 0.1084 1
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.0146 0.0213 0.5
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0146 0.0213 0.0204
Toxoplasma gondii subtilisin SUB6 0.0146 0.0213 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0119 0.0157 0.5119
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0146 0.0213 0.0204
Loa Loa (eye worm) AGC/AKT protein kinase 0.0074 0.006 0.0045
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Echinococcus granulosus peptidase s8 s53 subtilisin kexin sedolisin 0.1765 0.3682 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Entamoeba histolytica protein kinase, putative 0.0074 0.006 0.0549
Schistosoma mansoni tripeptidyl-peptidase II (S08 family) 0.4715 1 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0744 0.1495 0.1483
Echinococcus granulosus Furin 1 0.0146 0.0213 0.0579
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0322 0.0591 0.1605
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0183 0.0292 0.0283
Echinococcus multilocularis Peptidase S8 S53, subtilisin kexin sedolisin 0.1765 0.3682 1
Trichomonas vaginalis conserved hypothetical protein 0.0146 0.0213 0.1966
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0183 0.0292 0.2696
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis PIKK family atypical protein kinase 0.0099 0.0113 0.104
Onchocerca volvulus 0.0146 0.0213 0.5
Schistosoma mansoni site-1 peptidase (S08 family) 0.0146 0.0213 0.0204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0053 0.0014 0.0132
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0091 0.0097 0.4563
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0835 0.169 0.1682
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0183 0.0292 0.2696
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0526 0.1029 0.9491
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0051 0.001 0.009
Trichomonas vaginalis PIKK family atypical protein kinase 0.0099 0.0113 0.104
Trichomonas vaginalis PIKK family atypical protein kinase 0.0053 0.0014 0.0132
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0283 0.0507 0.0494
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0552 0.1084 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.0069 0.0638
Schistosoma mansoni furin-1 (S08 family) 0.0146 0.0213 0.0204
Trypanosoma brucei serine peptidase, clan SB, family S8-like protein 0.0146 0.0213 0.7155
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0461 0.0889 0.8201
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0117 0.0151 0.2568
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0536
Echinococcus multilocularis Zinc finger, PHD finger 0.0091 0.0097 0.0264
Plasmodium falciparum subtilisin-like protease 3 0.0146 0.0213 1
Brugia malayi neuroendocrine convertase 1 precursor 0.0146 0.0213 0.0199
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trichomonas vaginalis PIKK family atypical protein kinase 0.0084 0.0082 0.0752
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0053 0.0014 0.0134
Trichomonas vaginalis PIKK family atypical protein kinase 0.0079 0.0071 0.065
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0091 0.0097 0.0088
Toxoplasma gondii subtilisin SUB10 0.0146 0.0213 1
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0091 0.0097 0.0088
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0322 0.0591 0.0578
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0099 0.0113 0.3549
Trichomonas vaginalis PIKK family atypical protein kinase 0.0099 0.0113 0.104
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Trichomonas vaginalis conserved hypothetical protein 0.0146 0.0213 0.1966
Plasmodium vivax subtilisin-like protease 2, putative 0.0146 0.0213 1
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0157 0.0237 0.2187
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0091 0.0097 0.2982
Echinococcus granulosus membrane bound transcription factor site 1 0.0146 0.0213 0.0579
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0552 0.1084 1
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0091 0.0097 0.0898
Trichomonas vaginalis PIKK family atypical protein kinase 0.0053 0.0014 0.0132
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Toxoplasma gondii subtilisin SUB4 0.0146 0.0213 1
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0322 0.059 1
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0119 0.0157 0.7154
Trypanosoma cruzi target of rapamycin kinase 3 0.0099 0.0113 0.1043
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Brugia malayi Protein kinase domain containing protein 0.0074 0.006 0.0045
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0183 0.0292 0.2696
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0119 0.0157 0.1445
Leishmania major subtilisin-like serine peptidase 0.0146 0.0213 1
Plasmodium falciparum subtilisin-like protease 1 0.0146 0.0213 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0119 0.0157 0.1445
Brugia malayi celfurPC protein 0.0146 0.0213 0.0199
Loa Loa (eye worm) phosphatidylinositol 3 0.0119 0.0157 0.0142
Echinococcus granulosus serine/threonine protein kinase 0.0051 0.001 0.0027
Trypanosoma cruzi subtilisin peptidase 0.0146 0.0213 0.1967
Loa Loa (eye worm) hypothetical protein 0.0146 0.0213 0.0199
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0552 0.1084 1
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0091 0.0097 0.2908
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0091 0.0097 0.4167
Toxoplasma gondii subtilisin SUB7 0.0146 0.0213 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Giardia lamblia GTOR 0.0119 0.0157 0.2655
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0091 0.0097 0.0083
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0091 0.0097 0.0264
Echinococcus multilocularis Furin 1 0.0146 0.0213 0.0579
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0091 0.0097 0.0898
Entamoeba histolytica PH domain containing protein kinase, putative 0.0051 0.001 0.009
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0091 0.0097 0.0897
Entamoeba histolytica protein kinase, putative 0.0074 0.006 0.0549
Trichomonas vaginalis PIKK family atypical protein kinase 0.0119 0.0157 0.1444
Toxoplasma gondii subtilisin SUB11 0.0146 0.0213 1
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0552 0.1084 1
Mycobacterium leprae Possible secreted protease 0.0146 0.0213 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0146 0.0213 0.1966
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0091 0.0097 0.0264
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0091 0.0097 0.0897
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0146 0.0213 0.0579
Toxoplasma gondii subtilisin SUB8 0.0146 0.0213 1
Loa Loa (eye worm) hypothetical protein 0.0322 0.0591 0.0578
Plasmodium vivax subtilisin-like serine protease, putative 0.0146 0.0213 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0552 0.1084 1
Trypanosoma brucei rac serine-threonine kinase, putative 0.0074 0.006 0.1622
Toxoplasma gondii subtilisin SUB2 0.0146 0.0213 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0183 0.0292 0.2696
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0231 0.0396 0.3656
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.0069 0.0638
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trypanosoma cruzi serine peptidase, clan SB, family S8-like protein 0.0146 0.0213 0.1967
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0091 0.0097 0.0264
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.0146 0.0213 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0552 0.1084 0.1071
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Plasmodium falciparum subtilisin-like protease 2 0.0146 0.0213 1
Echinococcus multilocularis membrane bound transcription factor site 1 0.0146 0.0213 0.0579
Toxoplasma gondii target of rapamycin (TOR), putative 0.0094 0.0102 0.3185
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0119 0.0157 0.7154
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Toxoplasma gondii subtilisin SUB1 0.0146 0.0213 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0119 0.0157 0.1444
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0091 0.0097 0.0897
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0535
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0146 0.0213 0.1967
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.0146 0.0213 0.5
Echinococcus multilocularis neuroendocrine convertase 2 0.0146 0.0213 0.0579
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0183 0.0292 0.0278
Trichomonas vaginalis PIKK family atypical protein kinase 0.0099 0.0113 0.104
Trichomonas vaginalis PIKK family atypical protein kinase 0.0094 0.0102 0.0939
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0119 0.0157 0.5119
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0099 0.0113 0.496
Trichomonas vaginalis conserved hypothetical protein 0.0146 0.0213 0.1966
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0146 0.0213 0.1967
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0119 0.0157 0.1445
Loa Loa (eye worm) phosphatidylinositol 3 0.0157 0.0237 0.0223
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0091 0.0097 0.0898
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0146 0.0213 0.0579
Entamoeba histolytica PH domain containing protein kinase, putative 0.0051 0.001 0.009
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis PIKK family atypical protein kinase 0.0086 0.0086 0.0794
Echinococcus multilocularis 0.0146 0.0213 0.0579
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Toxoplasma gondii subtilisin SUB12 0.0146 0.0213 1
Schistosoma mansoni site-1 peptidase (S08 family) 0.0146 0.0213 0.0204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0536
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Trichomonas vaginalis PIKK family atypical protein kinase 0.0073 0.0058 0.0536
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0183 0.0292 1
Echinococcus multilocularis rac serine:threonine kinase 0.0051 0.001 0.0027
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0119 0.0157 0.0147
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0119 0.0157 0.0425
Brugia malayi p70 ribosomal S6 kinase beta 0.0069 0.005 0.0035
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0146 0.0213 0.1966
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0091 0.0097 0.2908
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0067 0.0044 0.1059
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0835 0.169 0.4589
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0146 0.0213 0.0204
Trichomonas vaginalis AGC family protein kinase 0.0074 0.006 0.0548
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.0146 0.0213 0.5
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0053 0.0014 0.0005
Trichomonas vaginalis PIKK family atypical protein kinase 0.0079 0.0071 0.065
Echinococcus granulosus tm gpcr rhodopsin 0.0548 0.1074 0.2917

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 10 ug ml-1 Inhibitory concentration against cytotoxicity in VERO cell line ChEMBL. 15801862
Inhibition (functional) = 91 % Tested for the inhibition of Mycobacterium tuberculosis growth at a dose of 6.25 ug/mL ChEMBL. 15801862
Inhibition (functional) = 91 % Tested for the inhibition of Mycobacterium tuberculosis growth at a dose of 6.25 ug/mL ChEMBL. 15801862
MIC (functional) = 6.25 ug ml-1 Minimum inhibitory concentration of the compound against Mycobacterium tuberculosis H37Rv ChEMBL. 15801862
MIC (functional) = 6.25 ug ml-1 Minimum inhibitory concentration of the compound against Mycobacterium tuberculosis H37Rv ChEMBL. 15801862
Selectivity index (functional) > 1.6 Selectivity index (IC50:MIC) of the compound ChEMBL. 15801862

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

1 literature reference was collected for this gene.

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