Detailed information for compound 2138355

Basic information

Technical information
  • TDR Targets ID: 2138355
  • Name: 4-[4-(2-oxochromen-7-yl)oxybutoxy]furo[3,2-g] chromen-7-one
  • MW: 418.105 | Formula: C24H18O7
  • H donors: 0 H acceptors: 2 LogP: 4.3 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 0
  • SMILES: O=c1ccc2c(o1)cc(cc2)OCCCCOc1c2ccoc2cc2c1ccc(=O)o2
  • InChi: InChI=1S/C24H18O7/c25-22-7-4-15-3-5-16(13-19(15)30-22)27-10-1-2-11-29-24-17-6-8-23(26)31-21(17)14-20-18(24)9-12-28-20/h3-9,12-14H,1-2,10-11H2
  • InChiKey: KXOBAZGZVFEVMY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[4-[(2-oxo-7-chromenyl)oxy]butoxy]-7-furo[3,2-g]chromenone
  • 4-[4-(2-ketochromen-7-yl)oxybutoxy]furo[3,2-g]chromen-7-one

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens potassium voltage-gated channel, shaker-related subfamily, member 3 No references
Homo sapiens potassium voltage-gated channel, shaker-related subfamily, member 5 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum Potassium voltage-gated channel subfamily A member 5, putative Get druggable targets OG5_127659 All targets in OG5_127659
Schistosoma japonicum Potassium voltage-gated channel protein Shaker, putative Get druggable targets OG5_127659 All targets in OG5_127659
Echinococcus multilocularis potassium voltage gated channel subfamily A Get druggable targets OG5_127659 All targets in OG5_127659
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_127659 All targets in OG5_127659
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit Get druggable targets OG5_127659 All targets in OG5_127659
Echinococcus granulosus potassium voltage gated channel protein Get druggable targets OG5_127659 All targets in OG5_127659
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127659 All targets in OG5_127659
Echinococcus granulosus potassium voltage gated channel subfamily A Get druggable targets OG5_127659 All targets in OG5_127659
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_127659 All targets in OG5_127659
Echinococcus multilocularis potassium voltage gated channel protein Get druggable targets OG5_127659 All targets in OG5_127659
Schistosoma japonicum ko:K04876 potassium voltage-gated channel, Shaker-related subfamily A, member, putative Get druggable targets OG5_127659 All targets in OG5_127659
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis voltage gated potassium channel potassium voltage-gated channel, shaker-related subfamily, member 5 613 aa 521 aa 34.9 %
Echinococcus granulosus shaker cognate potassium voltage-gated channel, shaker-related subfamily, member 3 575 aa 465 aa 34.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1226 0.1226
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Giardia lamblia Dipeptidyl-peptidase I precursor 0.014 0 0.5
Giardia lamblia Cathepsin L-like protease 0.014 0 0.5
Leishmania major cathepsin L-like protease 0.0758 1 1
Leishmania major cysteine peptidase A (CPA) 0.0758 1 1
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0535 0.639 0.639
Plasmodium vivax unspecified product 0.039 0.4054 0.4054
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0376 0.3815 0.3815
Giardia lamblia Cathepsin B-like cysteine proteinase 3 precursor 0.014 0 0.5
Entamoeba histolytica cysteine proteinase 2 0.039 0.4054 0.4054
Loa Loa (eye worm) hypothetical protein 0.0251 0.1791 0.1791
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Echinococcus granulosus cathepsin L cysteine protease 0.039 0.4054 0.4054
Giardia lamblia Hypothetical protein 0.014 0 0.5
Echinococcus granulosus cathepsin l1 0.0507 0.5946 0.5946
Brugia malayi Cathepsin L-like precursor 0.0758 1 1
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.2782 0.2782
Entamoeba histolytica cysteine proteinase, putative 0.0758 1 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0507 0.5946 0.5946
Trypanosoma cruzi cysteine peptidase, putative 0.0758 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Plasmodium vivax vivapain-2 0.0758 1 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0251 0.1791 0.1791
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Brugia malayi cathepsin F-like cysteine proteinase 0.0251 0.1791 0.1791
Brugia malayi Cathepsin L-like precursor 0.0507 0.5946 0.5946
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Toxoplasma gondii cathepsin CPL 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Loa Loa (eye worm) cysteine protease 0.0758 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0251 0.1791 0.1791
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Leishmania major cathepsin L-like protease 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Echinococcus granulosus cathepsin l1 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Entamoeba histolytica cysteine proteinase, putative 0.039 0.4054 0.4054
Giardia lamblia Dipeptidyl-peptidase I precursor 0.014 0 0.5
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Giardia lamblia Cysteine protease 0.014 0 0.5
Entamoeba histolytica cysteine proteinase, putative 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Schistosoma mansoni hypothetical protein 0.0353 0.344 0.344
Echinococcus granulosus potassium voltage gated channel protein 0.0397 0.4163 0.4163
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Giardia lamblia Cysteine protease 0.014 0 0.5
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0397 0.4163 0.4163
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Loa Loa (eye worm) hypothetical protein 0.0251 0.1791 0.1791
Schistosoma mansoni cathepsin F (C01 family) 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Onchocerca volvulus 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Entamoeba histolytica cysteine proteinase, putative 0.0507 0.5946 0.5946
Leishmania major cathepsin L-like protease 0.0758 1 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0758 1 1
Plasmodium vivax vivapain-1 0.039 0.4054 0.4054
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0507 0.5946 0.5946
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.039 0.4054 0.4054
Trypanosoma cruzi cysteine peptidase, putative 0.039 0.4054 0.4054
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1226 0.1226
Brugia malayi Papain family cysteine protease containing protein 0.0758 1 1
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0251 0.1791 0.1791
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Leishmania major cathepsin L-like protease 0.0758 1 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0758 1 1
Trypanosoma cruzi cysteine proteinase, putative 0.039 0.4054 0.4054
Leishmania major cathepsin L-like protease 0.0758 1 1
Entamoeba histolytica cysteine proteinase, putative 0.039 0.4054 0.4054
Plasmodium vivax unspecified product 0.0251 0.1791 0.1791
Onchocerca volvulus 0.0758 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Onchocerca volvulus Cathepsin F homolog 0.0758 1 1
Brugia malayi cathepsin L-like precursor 0.0507 0.5946 0.5946
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.039 0.4054 0.4054
Plasmodium vivax vivapain-2 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0758 1 1
Loa Loa (eye worm) hypothetical protein 0.0535 0.639 0.639
Plasmodium vivax vivapain-3 0.039 0.4054 0.4054
Echinococcus granulosus small conductance calcium activated potassium 0.0353 0.344 0.344
Echinococcus multilocularis small conductance calcium activated potassium 0.0353 0.344 0.344
Giardia lamblia Encystation-specific protease 0.014 0 0.5
Brugia malayi Cathepsin L-like precursor 0.0758 1 1
Giardia lamblia Cysteine protease 0.014 0 0.5
Leishmania major cathepsin L-like protease 0.0758 1 1
Echinococcus granulosus cathepsin L 0.039 0.4054 0.4054
Echinococcus granulosus cathepsin L cysteine proteinase 0.0758 1 1
Leishmania major cathepsin L-like protease 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Echinococcus multilocularis cysteine protease 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.0758 1 1
Echinococcus multilocularis cathepsin L 0.039 0.4054 0.4054
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Echinococcus multilocularis cathepsin L cysteine protease 0.0758 1 1
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Schistosoma mansoni calcium-activated potassium channel 0.0353 0.344 0.344
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0397 0.4163 0.4163
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.039 0.4054 0.4054
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.2782 0.2782
Brugia malayi Cathepsin L-like cysteine proteinase 0.0507 0.5946 0.5946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0758 1 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0758 1 1
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Onchocerca volvulus 0.0758 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0251 0.1791 0.1791
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Schistosoma mansoni cathepsin s 0.0251 0.1791 0.1791
Loa Loa (eye worm) hypothetical protein 0.0251 0.1791 0.1791
Brugia malayi Cathepsin L-like precursor 0.0251 0.1791 0.1791
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.1047 0.1047
Trypanosoma cruzi cysteine protease, putative 0.039 0.4054 0.4054
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.039 0.4054 0.4054
Brugia malayi Cathepsin L-like precursor 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Echinococcus multilocularis cathepsin L cysteine protease 0.0758 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0758 1 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.039 0.4054 0.4054
Brugia malayi Cathepsin L-like precursor 0.0507 0.5946 0.5946
Schistosoma mansoni voltage-gated potassium channel 0.0397 0.4163 0.4163
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Loa Loa (eye worm) fibroinase 0.0758 1 1
Loa Loa (eye worm) hypothetical protein 0.0758 1 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0758 1 1
Entamoeba histolytica cysteine proteinase, putative 0.039 0.4054 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Giardia lamblia Dipeptidyl-peptidase I precursor 0.014 0 0.5
Onchocerca volvulus 0.0535 0.639 0.639
Loa Loa (eye worm) hypothetical protein 0.0507 0.5946 0.5946
Brugia malayi Papain family cysteine protease containing protein 0.039 0.4054 0.4054
Onchocerca volvulus 0.0507 0.5946 0.5946
Loa Loa (eye worm) hypothetical protein 0.0397 0.4163 0.4163
Brugia malayi Cathepsin L-like precursor 0.0758 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0758 1 1
Loa Loa (eye worm) hypothetical protein 0.0353 0.344 0.344
Giardia lamblia Cathepsin L precursor 0.014 0 0.5
Echinococcus granulosus cysteine protease 0.039 0.4054 0.4054
Onchocerca volvulus 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2782 0.2782
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Echinococcus multilocularis potassium voltage gated channel protein 0.0397 0.4163 0.4163
Loa Loa (eye worm) hypothetical protein 0.0143 0.0048 0.0048
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.039 0.4054 0.4054
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Giardia lamblia Hypothetical protein 0.014 0 0.5
Onchocerca volvulus Cathepsin L homolog 0.0758 1 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0507 0.5946 0.5946
Onchocerca volvulus 0.0758 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.039 0.4054 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0758 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0397 0.4163 0.4163
Schistosoma mansoni cathepsin F (C01 family) 0.0507 0.5946 0.5946
Onchocerca volvulus 0.0758 1 1
Onchocerca volvulus Cathepsin L homolog 0.0758 1 1
Loa Loa (eye worm) ctsf protein 0.0758 1 1
Brugia malayi Cathepsin L-like precursor 0.0758 1 1
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Giardia lamblia Cathepsin L-like protease 0.014 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0507 0.5946 0.5946
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Entamoeba histolytica cysteine proteinase, putative 0.039 0.4054 0.4054
Loa Loa (eye worm) hypothetical protein 0.0507 0.5946 0.5946
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Echinococcus multilocularis cysteine protease 0.0758 1 1
Giardia lamblia Cysteine protease 0.014 0 0.5
Schistosoma mansoni calcium-activated potassium channel 0.0271 0.2122 0.2122
Brugia malayi Papain family cysteine protease containing protein 0.039 0.4054 0.4054
Trypanosoma cruzi cysteine peptidase, putative 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.039 0.4054 0.4054
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Leishmania major cathepsin L-like protease 0.0758 1 1
Brugia malayi hypothetical protein 0.0535 0.639 0.639
Giardia lamblia Cathepsin B precursor 0.014 0 0.5
Onchocerca volvulus 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1
Trypanosoma cruzi cysteine proteinase, putative 0.039 0.4054 0.4054
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Entamoeba histolytica cysteine protease, putative 0.039 0.4054 0.4054
Trypanosoma cruzi cruzipain precursor, putative 0.0758 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0758 1 1
Plasmodium falciparum cysteine proteinase falcipain 1 0.039 0.4054 0.4054
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1047 0.1047
Entamoeba histolytica cysteine proteinase 1, putative 0.039 0.4054 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0758 1 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) = 125 nM Inhibition of Kv1 PATENT. No reference
EC50 (binding) = 5 uM Inhibition of Kv1 PATENT. No reference

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

No literature references available for this target.

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