Detailed information for compound 1212738

Basic information

Technical information
  • TDR Targets ID: 1212738
  • Name: N-(furan-2-ylmethyl)-2-(2-oxo-1,3-benzoxazol- 3-yl)acetamide
  • MW: 272.256 | Formula: C14H12N2O4
  • H donors: 1 H acceptors: 2 LogP: 1.26 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Cn1c(=O)oc2c1cccc2)NCc1ccco1
  • InChi: 1S/C14H12N2O4/c17-13(15-8-10-4-3-7-19-10)9-16-11-5-1-2-6-12(11)20-14(16)18/h1-7H,8-9H2,(H,15,17)
  • InChiKey: HYHFDKWGFANMMO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-furylmethyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
  • N-(2-furylmethyl)-2-(2-keto-1,3-benzoxazol-3-yl)acetamide
  • N-(furan-2-ylmethyl)-2-(2-oxo-1,3-benzoxazol-3-yl)ethanamide
  • MLS000047118
  • N-(2-furylmethyl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
  • SMR000033129
  • ZINC02927531
  • ChemDiv3_013814
  • EU-0066053
  • STK239846

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens snurportin 1 No references
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens RAN, member RAS oncogene family No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania donovani GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania major GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Entamoeba histolytica Ran family GTPase Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis GTP-binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania mexicana GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Neospora caninum GTP-binding nuclear protein Ran, related Get druggable targets OG5_127514 All targets in OG5_127514
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Trypanosoma congolense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei gambiense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Cryptosporidium hominis GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva GTP-binding nuclear protein ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
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 peptidylprolyl isomerase, putative 0.06 1 1
Leishmania major peptidylprolyl isomerase-like protein 0.06 1 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.0083 0.1131 0.1061
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0597 0.0597
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-13 0.0083 0.1131 0.1131
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0312 0.0312
Schistosoma mansoni immunophilin 0.0518 0.8585 0.8585
Loa Loa (eye worm) hypothetical protein 0.0033 0.028 0.028
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0083 0.1131 0.1061
Trichomonas vaginalis conserved hypothetical protein 0.0083 0.1131 0.1061
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0312 0.0236
Trypanosoma cruzi FKBP-type peptidylprolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Toxoplasma gondii peptidyl-prolyl isomerase FKBP12, putative 0.0083 0.1131 1
Entamoeba histolytica hypothetical protein 0.0035 0.0311 0.0235
Schistosoma mansoni ap endonuclease 0.0021 0.0078 0.0078
Entamoeba histolytica hypothetical protein 0.0028 0.0199 0.0122
Trichomonas vaginalis fk506-binding protein, putative 0.0083 0.1131 0.1061
Trypanosoma cruzi FKBP-type peptidylprolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.06 1 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0078 0.0078
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0597 0.0597
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0518 0.8585 0.8585
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0078 0.0078
Schistosoma mansoni ran 0.0026 0.0155 0.0155
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Echinococcus granulosus snurportin 1 0.0372 0.6083 0.6083
Trichomonas vaginalis fk506 binding protein, putative 0.0083 0.1131 0.1061
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.06 1 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-30, BmFKBP-30 0.0083 0.1131 0.1131
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.0083 0.1131 1
Mycobacterium ulcerans hypothetical protein 0.0083 0.1131 0.1061
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0311 0.0311
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0311 0.0311
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.06 1 1
Brugia malayi hypothetical protein 0.0035 0.0311 0.0311
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.028 0.028
Trichomonas vaginalis fk506-binding protein, putative 0.0083 0.1131 0.1061
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0026 0.0155 0.0155
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0311 0.0311
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.06 1 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.6083 0.6083
Trypanosoma brucei hypothetical protein, conserved 0.0083 0.1131 0.1061
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.06 1 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.06 1 1
Leishmania major importin beta-1 subunit, putative 0.0028 0.0199 0.0122
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0083 0.1131 0.1061
Leishmania major peptidyl-prolyl cis-trans isomerase, macrophage infectivity potentiator precursor, putative 0.0083 0.1131 0.1061
Schistosoma mansoni hypothetical protein 0.0033 0.028 0.028
Echinococcus granulosus GTP binding nuclear protein Ran 0.0026 0.0155 0.0155
Plasmodium vivax importin-beta 2, putative 0.0035 0.0312 0.0236
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.06 1 1
Onchocerca volvulus 0.0083 0.1131 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0597 0.0597
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0597 0.0597
Schistosoma mansoni importin beta-1 0.0035 0.0312 0.0312
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.06 1 1
Echinococcus multilocularis fk506 binding protein 0.06 1 1
Schistosoma mansoni ran 0.0026 0.0155 0.0155
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0541 0.0541
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0155 0.0077
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0597 0.0597
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative 0.06 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0083 0.1131 0.1061
Trypanosoma brucei macrophage infectivity potentiator, precursor, putative 0.0083 0.1131 0.1061
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0541 0.0541
Trichomonas vaginalis ran, putative 0.0026 0.0155 0.0077
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-13, BmFKBP-13 0.0083 0.1131 0.1131
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.06 1 1
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0026 0.0155 0.0728
Brugia malayi RNA, U transporter 1 0.0099 0.1412 0.1412
Plasmodium falciparum importin beta, putative 0.0035 0.0312 0.0236
Loa Loa (eye worm) FKBP5 protein 0.06 1 1
Trichomonas vaginalis immunophilin, putative 0.06 1 1
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.06 1 1
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0.0155 0.0077
Loa Loa (eye worm) hypothetical protein 0.0083 0.1131 0.1131
Echinococcus multilocularis 0.0083 0.1131 0.1131
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-30 0.0083 0.1131 0.1131
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Schistosoma mansoni hypothetical protein 0.0372 0.6083 0.6083
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative 0.06 1 1
Entamoeba histolytica Ran family GTPase 0.0026 0.0155 0.0077
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0597 0.0597
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0199 0.0122
Onchocerca volvulus 0.0083 0.1131 0.5
Giardia lamblia Hypothetical protein 0.0083 0.1131 0.1061
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0155 0.0077
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-33, BmFKBP-33 0.0083 0.1131 0.1131
Echinococcus multilocularis snurportin 1 0.0372 0.6083 0.6083
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.06 1 1
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0312 0.2224
Leishmania major peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Loa Loa (eye worm) hypothetical protein 0.0518 0.8585 0.8585
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Leishmania major FKBP-type peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.06 1 1
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0078 0.0078
Schistosoma mansoni ap endonuclease 0.0021 0.0078 0.0078
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.06 1 1
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.06 1 1
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0026 0.0155 0.0155
Brugia malayi Importin beta-1 subunit 0.0035 0.0312 0.0312
Echinococcus granulosus FK506 binding protein 2 0.0083 0.1131 0.1131
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0026 0.0155 0.0155
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.06 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0597 0.0597
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0083 0.1131 0.1061
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.0083 0.1131 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0597 0.0597
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0199 0.0122
Brugia malayi MH2 domain containing protein 0.0244 0.389 0.389
Wolbachia endosymbiont of Brugia malayi FKBP-type peptidylprolyl isomerase 0.0083 0.1131 1
Echinococcus multilocularis FK506 binding protein 8, 38 kDa 0.0083 0.1131 0.1131
Entamoeba histolytica hypothetical protein 0.0035 0.0311 0.0235
Loa Loa (eye worm) hypothetical protein 0.0048 0.0541 0.0541
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.06 1 1
Entamoeba histolytica hypothetical protein 0.0035 0.0311 0.0235
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-33 0.0083 0.1131 0.1131
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0078 0.0078
Wolbachia endosymbiont of Brugia malayi FKBP-type peptidylprolyl isomerase 0.0083 0.1131 1
Schistosoma mansoni hypothetical protein 0.0083 0.1131 0.1131
Schistosoma mansoni hypothetical protein 0.0035 0.0311 0.0311
Loa Loa (eye worm) transcription factor SMAD2 0.0244 0.389 0.389
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type (slyD) 0.0083 0.1131 0.1061
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Loa Loa (eye worm) hypothetical protein 0.0035 0.0312 0.0312
Echinococcus granulosus FK506 binding protein 8 38 kDa 0.0083 0.1131 0.1131
Trypanosoma brucei FKBP-type peptidylprolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0155 0.0077
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0312 0.0236
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0199 0.0122
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.06 1 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0026 0.0155 0.0077
Leishmania major fk506-binding protein 1-like protein 0.06 1 1
Chlamydia trachomatis peptidyl-prolyl cis-trans isomerase 0.0083 0.1131 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0541 0.0541
Echinococcus granulosus importin subunit beta 1 0.0035 0.0312 0.0312
Plasmodium vivax peptidyl-prolyl cis-trans isomerase, putative 0.0083 0.1131 0.1061
Schistosoma mansoni immunophilin 0.06 1 1
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.06 1 1
Trypanosoma cruzi macrophage infectivity potentiator, precursor, putative 0.0083 0.1131 0.1061
Schistosoma mansoni fk506 binding protein 0.0083 0.1131 0.1131
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0199 0.0122
Loa Loa (eye worm) MH2 domain-containing protein 0.0244 0.389 0.389
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.06 1 1
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0518 0.8585 0.8585
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0026 0.0155 0.0077
Entamoeba histolytica hypothetical protein 0.0035 0.0311 0.0235
Trichomonas vaginalis fk506-binding protein, putative 0.06 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0597 0.0597
Schistosoma mansoni immunophilin 0.06 1 1
Mycobacterium tuberculosis Probable trigger factor (TF) protein Tig 0.0083 0.1131 1
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.0083 0.1131 1
Leishmania major GTP-binding protein, putative 0.0026 0.0155 0.0077
Mycobacterium leprae PROBABLE TRIGGER FACTOR (TF) PROTEIN TIG 0.0083 0.1131 0.5

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) = 30.12 % Inhibition of Mycobacterium tuberculosis recombinant His6-tagged InhA expressed in Escherichia coli BL21(DE3) using 2-trans-decenoyl-CoA as substrate at 10 uM incubated for 2 hrs prior to substrate addition by spectrophotometry ChEMBL. 25282650
Inhibition (ADMET) = 33.83 % Cytotoxicity against mouse RAW264.7 cells at 100 uM after 72 hrs by MTT assay ChEMBL. 25282650
MIC (functional) = 11.47 uM Antimicrobial activity against extensively drug-resistant Mycobacterium tuberculosis XDR-TB after 28 days by two-fold agar dilution method ChEMBL. 25282650
Potency (functional) 0.9285 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 2.0596 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] 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 Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] 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

1 literature reference was collected for this gene.

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