Detailed information for compound 1426776

Basic information

Technical information
  • TDR Targets ID: 1426776
  • Name: methyl (3R)-2-[2-(4-methyl-2-oxochromen-7-yl) oxyacetyl]-1,3,4,9-tetrahydropyrido[5,4-b]ind ole-3-carboxylate
  • MW: 446.452 | Formula: C25H22N2O6
  • H donors: 1 H acceptors: 3 LogP: 2.97 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)[C@H]1Cc2c(CN1C(=O)COc1ccc3c(c1)oc(=O)cc3C)[nH]c1c2cccc1
  • InChi: 1S/C25H22N2O6/c1-14-9-24(29)33-22-10-15(7-8-16(14)22)32-13-23(28)27-12-20-18(11-21(27)25(30)31-2)17-5-3-4-6-19(17)26-20/h3-10,21,26H,11-13H2,1-2H3/t21-/m1/s1
  • InChiKey: WNAYNBDAJBVOPW-OAQYLSRUSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • methyl (3R)-2-[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]-1,3,4,9-tetrahydropyrido[5,4-b]indole-3-carboxylate
  • (3R)-2-[2-[(4-methyl-2-oxo-7-chromenyl)oxy]-1-oxoethyl]-1,3,4,9-tetrahydropyrido[5,4-b]indole-3-carboxylic acid methyl ester
  • (3R)-2-[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid methyl ester
  • methyl (3R)-2-[2-(4-methyl-2-oxo-chromen-7-yl)oxyethanoyl]-1,3,4,9-tetrahydropyrido[5,4-b]indole-3-carboxylate

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
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
Loa Loa (eye worm) beta-lactamase 0.0171 0.0614 0.0614
Brugia malayi hypothetical protein 0.0049 0.0107 0.0107
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0048 0.0104 0.0316
Schistosoma mansoni hypothetical protein 0.0048 0.0104 0.0316
Mycobacterium ulcerans glutaminase 0.0547 0.2167 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0041 0.0078 0.0358
Mycobacterium tuberculosis Probable lipase LipD 0.0171 0.0614 0.1386
Mycobacterium leprae Probable lipase LipE 0.0171 0.0614 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 0.0099 0.0099
Plasmodium vivax ataxin-2 like protein, putative 0.0101 0.0323 0.5263
Echinococcus multilocularis aryl hydrocarbon receptor 0.0049 0.0108 0.0118
Schistosoma mansoni glutaminase 0.0547 0.2167 0.6606
Echinococcus multilocularis lysosome membrane protein 2 0.0816 0.3281 0.3582
Brugia malayi MH2 domain containing protein 0.0239 0.0895 0.0895
Leishmania major 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0074 0.0212 0.0827
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.046 0.181 0.5516
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0041 0.0078 0.0085
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0171 0.0614 0.1386
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Mycobacterium tuberculosis Probable esterase LipL 0.0171 0.0614 0.1386
Schistosoma mansoni hypothetical protein 0.0048 0.0104 0.0316
Plasmodium falciparum ataxin-2 like protein, putative 0.0101 0.0323 1
Mycobacterium ulcerans esterase/lipase LipP 0.0171 0.0614 0.2833
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0074 0.0212 0.0827
Loa Loa (eye worm) hypothetical protein 0.0117 0.039 0.039
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0171 0.0614 0.2833
Echinococcus granulosus citrate lyase subunit beta protein 0.0074 0.0212 0.0645
Onchocerca volvulus 0.0171 0.0614 0.0602
Echinococcus multilocularis CD36 class B scavenger receptor 0.0816 0.3281 0.3582
Trichomonas vaginalis glutaminase, putative 0.0547 0.2167 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0078 0.0078
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.2238 0.9158 1
Brugia malayi aryl hydrocarbon receptor nuclear translocator protein, putative 0.0034 0.0047 0.0047
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0078 0.0358
Loa Loa (eye worm) hypothetical protein 0.0308 0.1181 0.1181
Loa Loa (eye worm) hypothetical protein 0.0026 0.0013 0.0013
Schistosoma mansoni hypothetical protein 0.0495 0.1951 0.5948
Loa Loa (eye worm) paired box protein 0.0047 0.0099 0.0099
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0041 0.0078 0.0085
Mycobacterium ulcerans lipase LipD 0.0171 0.0614 0.2833
Onchocerca volvulus 0.0171 0.0614 0.0602
Echinococcus multilocularis CD36 class B scavenger receptor 0.0816 0.3281 0.3582
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0041 0.0078 0.0303
Brugia malayi latrophilin 2 splice variant baaae 0.0103 0.0333 0.0333
Schistosoma mansoni hypothetical protein 0.0045 0.0093 0.0284
Echinococcus multilocularis paired box protein pax 1 0.0047 0.0099 0.0109
Loa Loa (eye worm) glutaminase 2 0.0547 0.2167 0.2167
Brugia malayi beta-lactamase 0.0171 0.0614 0.0614
Brugia malayi hypothetical protein 0.0034 0.0046 0.0046
Brugia malayi Latrophilin receptor protein 2 0.0048 0.0104 0.0104
Loa Loa (eye worm) hypothetical protein 0.0048 0.0104 0.0104
Mycobacterium tuberculosis Probable hydrolase 0.0171 0.0614 0.1386
Brugia malayi intermediate filament protein 0.0026 0.0013 0.0013
Schistosoma mansoni hypothetical protein 0.0048 0.0104 0.0316
Echinococcus granulosus paired box protein pax 6 0.0047 0.0099 0.0303
Schistosoma mansoni paired box protein pax-6 0.0047 0.0099 0.0303
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0013 0.0013
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0048 0.0104 0.0316
Trichomonas vaginalis D-aminoacylase, putative 0.0171 0.0614 0.2833
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0048 0.0104 0.0113
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0171 0.0614 0.1872
Brugia malayi hypothetical protein 0.0117 0.039 0.039
Leishmania major hypothetical protein, conserved 0.0101 0.0323 0.1263
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Entamoeba histolytica hypothetical protein 0.0075 0.0215 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0101 0.0323 0.1263
Brugia malayi aryl hydrocarbon receptor AHR-1 0.0034 0.0046 0.0046
Loa Loa (eye worm) hypothetical protein 0.0034 0.0046 0.0046
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.046 0.181 0.1976
Echinococcus granulosus CD36 class B scavenger receptor 0.0816 0.3281 1
Mycobacterium ulcerans citrate lyase beta subunit, CitE_2 0.0074 0.0212 0.0976
Schistosoma mansoni paired box protein pax-1-related 0.0047 0.0099 0.0303
Loa Loa (eye worm) transcription factor SMAD2 0.0239 0.0895 0.0895
Brugia malayi photoreceptor-specific nuclear receptor 0.0218 0.0807 0.0807
Brugia malayi 'Paired box' domain containing protein 0.0047 0.0099 0.0099
Loa Loa (eye worm) hypothetical protein 0.0117 0.039 0.039
Echinococcus granulosus GPCR family 2 0.0048 0.0104 0.0316
Brugia malayi Calcitonin receptor-like protein seb-1 0.0151 0.0531 0.0531
Echinococcus granulosus CD36 class B scavenger receptor 0.0816 0.3281 1
Echinococcus multilocularis paired box protein pax 6 0.0047 0.0099 0.0109
Onchocerca volvulus Retinal homeobox protein Rx homolog 0.0047 0.0099 0.0087
Echinococcus multilocularis lamin dm0 0.0026 0.0013 0.0014
Brugia malayi 'Paired box' domain containing protein 0.0047 0.0099 0.0099
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0041 0.0078 0.0237
Trichomonas vaginalis Citrate lyase beta chain, putative 0.0074 0.0212 0.0976
Brugia malayi beta-lactamase family protein 0.0171 0.0614 0.0614
Schistosoma mansoni CD36-like class B scavenger receptor 0.0816 0.3281 1
Echinococcus multilocularis paired box protein pax 6 0.0047 0.0099 0.0109
Loa Loa (eye worm) hypothetical protein 0.0034 0.0046 0.0046
Loa Loa (eye worm) hypothetical protein 0.0101 0.0323 0.0323
Loa Loa (eye worm) hypothetical protein 0.0308 0.1181 0.1181
Brugia malayi hypothetical protein 0.0034 0.0047 0.0047
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0171 0.0614 0.0614
Plasmodium falciparum ataxin-2 like protein, putative 0.0101 0.0323 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0099 0.0099
Loa Loa (eye worm) hypothetical protein 0.0816 0.3281 0.3281
Mycobacterium leprae conserved hypothetical protein 0.0171 0.0614 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.046 0.181 0.5516
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0171 0.0614 0.1872
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0013 0.0013
Brugia malayi hypothetical protein 0.0308 0.1181 0.1181
Loa Loa (eye worm) pax transcription factor protein 2 0.2442 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.0614 0.24
Toxoplasma gondii LsmAD domain-containing protein 0.0101 0.0323 0.5263
Onchocerca volvulus Lysosome membrane protein 2 homolog 0.0816 0.3281 0.3272
Trichomonas vaginalis penicillin-binding protein, putative 0.0171 0.0614 0.2833
Echinococcus granulosus geminin 0.0495 0.1951 0.5948
Echinococcus granulosus beta LACTamase domain containing family member 0.0171 0.0614 0.1872
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0045 0.0093 0.0284
Loa Loa (eye worm) helix-loop-helix DNA-binding domain-containing protein 0.0034 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0103 0.0333 0.0333
Echinococcus granulosus paired box protein pax 1 0.0047 0.0099 0.0303
Trichomonas vaginalis esterase, putative 0.0171 0.0614 0.2833
Onchocerca volvulus 0.0171 0.0614 0.0602
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0171 0.0614 0.1386
Brugia malayi CD36 family protein 0.0816 0.3281 0.3281
Loa Loa (eye worm) hypothetical protein 0.0308 0.1181 0.1181
Schistosoma mansoni hypothetical protein 0.0495 0.1951 0.5948
Trypanosoma brucei PAB1-binding protein , putative 0.0101 0.0323 0.1263
Loa Loa (eye worm) hypothetical protein 0.0151 0.0531 0.0531
Loa Loa (eye worm) hypothetical protein 0.0816 0.3281 0.3281
Mycobacterium ulcerans hypothetical protein 0.0074 0.0212 0.0976
Echinococcus multilocularis geminin 0.0495 0.1951 0.2131
Entamoeba histolytica hypothetical protein 0.0075 0.0215 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0171 0.0614 0.0614
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0041 0.0078 0.0237
Echinococcus multilocularis GPCR, family 2 0.0048 0.0104 0.0113
Echinococcus multilocularis paired box protein pax 6 0.0047 0.0099 0.0109
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0041 0.0078 0.3618
Loa Loa (eye worm) hypothetical protein 0.0047 0.0099 0.0099
Trichomonas vaginalis penicillin-binding protein, putative 0.0171 0.0614 0.2833
Trypanosoma cruzi PAB1-binding protein , putative 0.0101 0.0323 0.1263
Echinococcus granulosus paired box protein pax 6 0.0047 0.0099 0.0303
Schistosoma mansoni intermediate filament proteins 0.0026 0.0013 0.0038
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0041 0.0078 0.0303
Loa Loa (eye worm) hypothetical protein 0.0034 0.0046 0.0046
Echinococcus multilocularis citrate lyase subunit beta protein 0.0074 0.0212 0.0231
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.046 0.181 0.181
Onchocerca volvulus 0.0047 0.0099 0.0087
Trichomonas vaginalis D-aminoacylase, putative 0.0171 0.0614 0.2833
Schistosoma mansoni hypothetical protein 0.0048 0.0104 0.0316
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.046 0.181 0.181
Schistosoma mansoni paired box protein pax-6 0.0047 0.0099 0.0303
Brugia malayi 'Paired box' domain containing protein 0.0047 0.0099 0.0099
Toxoplasma gondii ABC1 family protein 0.0171 0.0614 1
Brugia malayi glutaminase DH11.1 0.0547 0.2167 0.2167
Mycobacterium tuberculosis Probable citrate (pro-3S)-lyase (beta subunit) CitE (citrase) (citratase) (citritase) (citridesmolase) (citrase aldolase) 0.0074 0.0212 0.0478
Mycobacterium ulcerans beta-lactamase 0.0171 0.0614 0.2833
Brugia malayi hypothetical protein 0.0065 0.0175 0.0175
Brugia malayi hypothetical protein 0.0308 0.1181 0.1181
Schistosoma mansoni CD36-like class B scavenger receptor 0.0816 0.3281 1
Echinococcus multilocularis CD36 class B scavenger receptor 0.0816 0.3281 0.3582
Loa Loa (eye worm) MH2 domain-containing protein 0.0239 0.0895 0.0895
Trypanosoma cruzi hypothetical protein, conserved 0.0171 0.0614 0.24
Echinococcus multilocularis ubiquitin specific protease 41 0.0041 0.0078 0.0085
Echinococcus multilocularis musashi 0.0026 0.0013 0.0014
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0013 0.0013
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Mycobacterium ulcerans hypothetical protein 0.0171 0.0614 0.2833
Loa Loa (eye worm) hypothetical protein 0.0049 0.0107 0.0107
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0048 0.0104 0.0113
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0074 0.0212 0.0827
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0171 0.0614 0.1386
Echinococcus granulosus lysosome membrane protein 2 0.0816 0.3281 1
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0074 0.0212 0.0976
Schistosoma mansoni lamin 0.0026 0.0013 0.0038
Echinococcus granulosus paired box gene 3/7 (eyeless, eyegone, twin of eyeless) 0.0047 0.0099 0.0303
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0041 0.0078 0.0358
Leishmania major hypothetical protein, conserved 0.0171 0.0614 0.24
Echinococcus multilocularis lamin 0.0026 0.0013 0.0014
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0074 0.0212 0.0976
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.046 0.181 0.5516
Loa Loa (eye worm) hypothetical protein 0.0171 0.0614 0.0614
Trypanosoma cruzi hypothetical protein, conserved 0.0642 0.2559 1
Leishmania major hypothetical protein, conserved 0.0642 0.2559 1
Schistosoma mansoni lamin 0.0026 0.0013 0.0038
Mycobacterium tuberculosis Conserved protein 0.0171 0.0614 0.1386
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0 0.5
Onchocerca volvulus Huntingtin homolog 0.0117 0.039 0.0378
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0041 0.0078 0.0303
Brugia malayi paired box protein 0.0047 0.0099 0.0099
Echinococcus granulosus CD36 class B scavenger receptor 0.0816 0.3281 1
Echinococcus granulosus aryl hydrocarbon receptor 0.0049 0.0108 0.0328
Brugia malayi Helix-loop-helix DNA-binding domain containing protein 0.0034 0.0047 0.0047
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0048 0.0104 0.0104
Echinococcus granulosus lamin 0.0026 0.0013 0.0038
Trypanosoma brucei hypothetical protein, conserved 0.0171 0.0614 0.24
Brugia malayi paired box pox-meso protein 0.0047 0.0099 0.0099
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.046 0.181 0.5516
Trypanosoma brucei hypothetical protein, conserved 0.0642 0.2559 1
Entamoeba histolytica hypothetical protein 0.0075 0.0215 1
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0049 0.0108 0.0108
Loa Loa (eye worm) hypothetical protein 0.0816 0.3281 0.3281
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.046 0.181 0.1976
Onchocerca volvulus 0.0047 0.0099 0.0087
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0041 0.0078 0.0303
Echinococcus multilocularis beta LACTamase domain containing family member 0.0171 0.0614 0.0671
Mycobacterium tuberculosis Probable lipase LipE 0.0171 0.0614 0.1386
Echinococcus granulosus CD36 class B scavenger receptor 0.0816 0.3281 1
Schistosoma mansoni paired box protein pax-6 0.0047 0.0099 0.0303
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0151 0.0531 0.0531
Echinococcus granulosus lamin dm0 0.0026 0.0013 0.0038
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0151 0.0531 0.0531
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0041 0.0078 1
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0041 0.0078 0.0237
Mycobacterium tuberculosis Conserved protein 0.0074 0.0212 0.0478
Brugia malayi vab-3 gene. 0.0047 0.0099 0.0099
Loa Loa (eye worm) vab-3 0.0047 0.0099 0.0099
Trypanosoma cruzi hypothetical protein, conserved 0.0642 0.2559 1
Plasmodium vivax hypothetical protein, conserved 0.0171 0.0614 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0011 0.0011
Trichomonas vaginalis D-aminoacylase, putative 0.0171 0.0614 0.2833
Schistosoma mansoni transcription factor LCR-F1 0.0075 0.0215 0.0654
Echinococcus granulosus CD36 class B scavenger receptor 0.0816 0.3281 1
Echinococcus granulosus ubiquitin specific protease 41 0.0041 0.0078 0.0237
Mycobacterium tuberculosis Conserved protein 0.0171 0.0614 0.1386
Echinococcus granulosus intermediate filament protein 0.0026 0.0013 0.0038
Mycobacterium ulcerans hypothetical protein 0.0074 0.0212 0.0976
Loa Loa (eye worm) hypothetical protein 0.0218 0.0807 0.0807
Entamoeba histolytica hypothetical protein 0.0075 0.0215 1
Schistosoma mansoni hypothetical protein 0.0103 0.0333 0.1016
Loa Loa (eye worm) hypothetical protein 0.0034 0.0046 0.0046
Onchocerca volvulus 0.0049 0.0107 0.0094
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0045 0.0093 0.0102
Loa Loa (eye worm) glutaminase 0.0547 0.2167 0.2167
Onchocerca volvulus Huntingtin homolog 0.0117 0.039 0.0378
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0 0.5
Brugia malayi beta-lactamase family protein 0.0171 0.0614 0.0614
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0075 0.0215 0.0234
Schistosoma mansoni scavenger receptor class B type-2 (sr-B2) 0.0816 0.3281 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.046 0.181 0.5516
Onchocerca volvulus Protein cycle homolog 0.0034 0.0047 0.0035
Echinococcus multilocularis CD36 class B scavenger receptor 0.0816 0.3281 0.3582
Schistosoma mansoni aryl hydrocarbon receptor nuclear translocator homolog (darnt) 0.0034 0.0047 0.0145
Mycobacterium tuberculosis Possible penicillin-binding protein 0.1094 0.4429 1
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0041 0.0078 0.0078
Schistosoma mansoni cd36 antigen 0.0308 0.1181 0.3599
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0041 0.0078 0.0237
Loa Loa (eye worm) latrophilin receptor protein 2 0.0048 0.0104 0.0104
Onchocerca volvulus 0.2442 1 1
Mycobacterium tuberculosis Conserved protein 0.0171 0.0614 0.1386
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0075 0.0215 0.0654
Brugia malayi Gooseberry protein 0.0047 0.0099 0.0099
Echinococcus multilocularis CD36 class B scavenger receptor 0.0816 0.3281 0.3582
Loa Loa (eye worm) hypothetical protein 0.0047 0.0099 0.0099
Brugia malayi hypothetical protein 0.0101 0.0323 0.0323
Brugia malayi hypothetical protein 0.0075 0.0215 0.0215
Schistosoma mansoni hypothetical protein 0.0075 0.0215 0.0654

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0316 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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