Detailed information for compound 1182964

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 382.406 | Formula: C22H22O6
  • H donors: 2 H acceptors: 3 LogP: 4.31 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(/C=C/C(=O)/C=C(/C=C/c2ccc(cc2)O)\O)cc(c1OC)OC
  • InChi: 1S/C22H22O6/c1-26-20-12-16(13-21(27-2)22(20)28-3)7-11-19(25)14-18(24)10-6-15-4-8-17(23)9-5-15/h4-14,23-24H,1-3H3/b10-6+,11-7+,18-14-
  • InChiKey: KDRIZWCGRMRUFA-SDPRYRQNSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.017 0.0292
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Plasmodium vivax glutathione reductase, putative 0.0048 0.0103 0.0059
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.027 0.1416 0.1731
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0122 0.0541 0.1239
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Mycobacterium tuberculosis Conserved protein 0.011 0.0469 0.1056
Mycobacterium leprae conserved hypothetical protein 0.011 0.0469 0.0105
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.011 0.0468 0.1054
Plasmodium falciparum cysteine proteinase falcipain 3 0.1371 0.7916 1
Onchocerca volvulus Cathepsin L homolog 0.1371 0.7916 1
Loa Loa (eye worm) hypothetical protein 0.0446 0.2454 0.2454
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0122 0.0541 0.1239
Brugia malayi cathepsin Z-like cysteine proteinase 0.027 0.1416 0.1416
Loa Loa (eye worm) hypothetical protein 0.0446 0.2454 0.2454
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0209 0.0209
Trypanosoma brucei hypothetical protein, conserved 0.011 0.0469 0.0527
Brugia malayi Cathepsin L-like precursor 0.0925 0.528 0.528
Trypanosoma cruzi major cysteine proteinase, putative 0.027 0.1416 0.1731
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Giardia lamblia Cathepsin B precursor 0.0484 0.2675 0.6693
Entamoeba histolytica cysteine proteinase 2 0.0717 0.4051 0.5083
Brugia malayi hypothetical protein 0.0241 0.1241 0.1241
Onchocerca volvulus Cathepsin F homolog 0.1371 0.7916 1
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Entamoeba histolytica papain family cysteine protease domain containing protein 0.027 0.1416 0.1731
Echinococcus granulosus microtubule associated protein 2 0.0732 0.414 0.412
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.027 0.1416 0.1728
Giardia lamblia Cathepsin B precursor 0.0484 0.2675 0.6693
Brugia malayi cahepsin L-like non-peptiedase homolog 0.027 0.1416 0.1416
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Schistosoma mansoni subfamily C1A non-peptidase homologue (C01 family) 0.027 0.1416 0.1752
Brugia malayi Papain family cysteine protease containing protein 0.027 0.1416 0.1416
Schistosoma mansoni lamin 0.0057 0.0157 0.0155
Loa Loa (eye worm) hypothetical protein 0.0056 0.0151 0.0151
Mycobacterium tuberculosis Conserved protein 0.011 0.0469 0.1056
Brugia malayi RNA binding protein 0.0066 0.0209 0.0209
Trypanosoma brucei PAB1-binding protein , putative 0.0082 0.0301 0.0313
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Brugia malayi cathepsin L-like cysteine proteinase 0.027 0.1416 0.1416
Brugia malayi beta-lactamase family protein 0.011 0.0469 0.0469
Giardia lamblia Cathepsin B precursor 0.027 0.1416 0.3476
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0717 0.4051 0.5096
Giardia lamblia Cathepsin B precursor 0.027 0.1416 0.3476
Giardia lamblia Cathepsin B precursor 0.0484 0.2675 0.6693
Trypanosoma cruzi PAB1-binding protein , putative 0.0082 0.0301 0.0313
Loa Loa (eye worm) hypothetical protein 0.0446 0.2454 0.2454
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Echinococcus granulosus intermediate filament protein 0.0057 0.0157 0.0122
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.027 0.1416 0.1728
Brugia malayi Thioredoxin reductase 0.0048 0.0103 0.0103
Brugia malayi Papain family cysteine protease containing protein 0.027 0.1416 0.1416
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.0469 0.0551
Toxoplasma gondii LsmAD domain-containing protein 0.0082 0.0301 0.031
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.0103 0.0123
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Brugia malayi cathepsin Z-like cysteine proteinase 0.027 0.1416 0.1416
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.011 0.0469 0.1056
Brugia malayi fibroinase precursor 0.027 0.1416 0.1416
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Plasmodium vivax vivapain-2 0.1371 0.7916 1
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.004 0.0057 0.0003
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.027 0.1416 0.1752
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.011 0.0468 0.1054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Giardia lamblia Cathepsin L-like protease 0.027 0.1416 0.3476
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Onchocerca volvulus 0.011 0.0469 0.0462
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Schistosoma mansoni cathepsin F (C01 family) 0.1371 0.7916 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.011 0.0469 0.0436
Plasmodium vivax serine-repeat antigen 4 (SERA) 0.027 0.1416 0.1728
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0099 0.0403 0.0888
Loa Loa (eye worm) hypothetical protein 0.0082 0.0301 0.0301
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.027 0.1416 0.1728
Plasmodium vivax serine-repeat antigen 3 (SERA) 0.027 0.1416 0.1728
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0717 0.4051 0.5083
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.027 0.1416 0.1752
Schistosoma mansoni cathepsin B (C01 family) 0.027 0.1416 0.1752
Plasmodium falciparum ataxin-2 like protein, putative 0.0082 0.0301 0.031
Echinococcus granulosus lamin dm0 0.0057 0.0157 0.0122
Plasmodium falciparum serine repeat antigen 4 0.027 0.1416 0.1728
Echinococcus multilocularis ubiquitin conjugating enzyme E2 N 0.004 0.0057 0.0022
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.0469 0.0551
Loa Loa (eye worm) cysteine protease 0.1371 0.7916 0.7916
Entamoeba histolytica cysteine proteinase, putative 0.1371 0.7916 1
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.027 0.1416 0.1752
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.004 0.0057 0.0003
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.0469 0.0527
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Echinococcus granulosus cathepsin b 0.096 0.5486 0.547
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Brugia malayi cathepsin B-like cysteine proteinase 0.096 0.5486 0.5486
Toxoplasma gondii thioredoxin reductase 0.0048 0.0103 0.0059
Schistosoma mansoni survival motor neuron protein 0.0049 0.0109 0.0093
Loa Loa (eye worm) hypothetical protein 0.096 0.5486 0.5486
Loa Loa (eye worm) hypothetical protein 0.0241 0.1241 0.1241
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.004 0.0055 0.0025
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Mycobacterium tuberculosis Probable lipase LipE 0.011 0.0469 0.1056
Brugia malayi Papain family cysteine protease containing protein 0.027 0.1416 0.1416
Giardia lamblia Dipeptidyl-peptidase I precursor 0.027 0.1416 0.3476
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Loa Loa (eye worm) ctsf protein 0.1371 0.7916 0.7916
Trypanosoma cruzi cysteine peptidase, putative 0.1371 0.7916 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or H-like cysteine peptidase 0.027 0.1416 0.1731
Plasmodium falciparum serine repeat antigen 6 0.027 0.1416 0.1728
Loa Loa (eye worm) papain family cysteine protease containing protein 0.1371 0.7916 0.7916
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.004 0.0057 0.0003
Schistosoma mansoni cathepsin F (C01 family) 0.0925 0.528 0.6656
Plasmodium vivax serine-repeat antigen (SERA), putative 0.027 0.1416 0.1728
Schistosoma mansoni intermediate filament proteins 0.0057 0.0157 0.0155
Trichomonas vaginalis Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase 0.027 0.1416 0.1731
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.1371 0.7916 1
Trypanosoma cruzi major cysteine proteinase, putative 0.027 0.1416 0.1731
Entamoeba histolytica cysteine proteinase, putative 0.0717 0.4051 0.5083
Giardia lamblia Cysteine protease 0.027 0.1416 0.3476
Trypanosoma brucei trypanothione reductase 0.0048 0.0103 0.0061
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.017 0.2766
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.027 0.1416 0.1752
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.017 0.0171
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Plasmodium vivax ataxin-2 like protein, putative 0.0082 0.0301 0.031
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0704 0.3975 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0209 0.022
Echinococcus granulosus lamin 0.0057 0.0157 0.0122
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Plasmodium vivax vivapain-2 0.1371 0.7916 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0099 0.0403 0.0886
Plasmodium vivax serine-repeat antigen 2 (SERA) 0.027 0.1416 0.1728
Echinococcus multilocularis geminin 0.0715 0.4042 0.4021
Entamoeba histolytica cysteine proteinase, putative 0.1371 0.7916 1
Entamoeba histolytica cysteine proteinase, putative 0.0717 0.4051 0.5083
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.0103 0.0069
Echinococcus multilocularis dna polymerase eta 0.004 0.0055 0.002
Echinococcus multilocularis cathepsin L 0.0717 0.4051 0.403
Onchocerca volvulus 0.1371 0.7916 1
Echinococcus granulosus cathepsin b 0.096 0.5486 0.547
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Giardia lamblia Cathepsin B-like cysteine proteinase 3 precursor 0.027 0.1416 0.3476
Schistosoma mansoni microtubule-associated protein tau 0.0732 0.414 0.5209
Leishmania major hypothetical protein, conserved 0.011 0.0469 0.0527
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.0925 0.528 0.528
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0717 0.4051 0.5096
Brugia malayi TAR-binding protein 0.0066 0.0209 0.0209
Onchocerca volvulus 0.011 0.0469 0.0462
Toxoplasma gondii ABC1 family protein 0.011 0.0469 0.0524
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.027 0.1416 0.1731
Giardia lamblia Cathepsin B precursor 0.027 0.1416 0.3476
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Trichomonas vaginalis Clan CA, family C1, cathepsin F-like cysteine peptidase 0.027 0.1416 0.1731
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Brugia malayi ubiquitin conjugating enzyme protein 13 0.004 0.0057 0.0057
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0446 0.2454 0.2454
Loa Loa (eye worm) papain family cysteine protease containing protein 0.027 0.1416 0.1416
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.096 0.5486 0.6917
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Entamoeba histolytica cysteine proteinase, putative 0.0717 0.4051 0.5083
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Echinococcus multilocularis cysteine protease 0.1371 0.7916 0.7908
Brugia malayi cathepsin L precursor 0.027 0.1416 0.1416
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0717 0.4051 0.5083
Entamoeba histolytica hypothetical protein 0.027 0.1416 0.1731
Mycobacterium tuberculosis Putative ferredoxin reductase 0.011 0.0468 0.1054
Echinococcus granulosus ubiquitin conjugating enzyme E2 N 0.004 0.0057 0.0022
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Plasmodium vivax serine-repeat antigen 5 (SERA) 0.027 0.1416 0.1728
Plasmodium vivax hypothetical protein, conserved 0.011 0.0469 0.0524
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.0469 0.0527
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Giardia lamblia Cathepsin L-like protease 0.027 0.1416 0.3476
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.017 0.0135
Brugia malayi glutathione reductase 0.0048 0.0103 0.0103
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.027 0.1416 0.1731
Brugia malayi Papain family cysteine protease containing protein 0.1371 0.7916 0.7916
Entamoeba histolytica hypothetical protein 0.02 0.0999 0.1201
Mycobacterium ulcerans hypothetical protein 0.011 0.0469 1
Brugia malayi beta-lactamase 0.011 0.0469 0.0469
Onchocerca volvulus 0.1371 0.7916 1
Schistosoma mansoni ap endonuclease 0.0099 0.0403 0.0466
Trypanosoma brucei cysteine peptidase C (CPC) 0.0484 0.2675 0.3332
Loa Loa (eye worm) papain family cysteine protease containing protein 0.027 0.1416 0.1416
Brugia malayi hypothetical protein 0.0053 0.013 0.013
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0209 0.022
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.027 0.1416 0.1731
Echinococcus multilocularis cathepsin L cysteine protease 0.1371 0.7916 0.7908
Brugia malayi hypothetical protein 0.0082 0.0301 0.0301
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0209 0.0174
Mycobacterium tuberculosis Probable hydrolase 0.011 0.0469 0.1056
Plasmodium vivax unspecified product 0.0717 0.4051 0.5082
Schistosoma mansoni ap endonuclease 0.0099 0.0403 0.0466
Echinococcus granulosus cathepsin l cysteine peptidase 0.1371 0.7916 0.7908
Brugia malayi MH2 domain containing protein 0.025 0.1297 0.1297
Trypanosoma brucei ubiquitin-protein ligase, putative 0.004 0.0057 0.0003
Brugia malayi ImpB/MucB/SamB family protein 0.004 0.0055 0.0055
Echinococcus multilocularis musashi 0.0057 0.0157 0.0122
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0099 0.0403 0.0369
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.004 0.0055 0.002
Loa Loa (eye worm) hypothetical protein 0.004 0.0055 0.0055
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0209 0.0209
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.017 0.0143
Plasmodium vivax vivapain-1 0.0717 0.4051 0.5082
Echinococcus multilocularis survival motor neuron protein 1 0.0241 0.1241 0.121
Plasmodium falciparum serine repeat antigen 9 0.027 0.1416 0.1728
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.027 0.1416 0.1752
Entamoeba histolytica cysteine proteinase, putative 0.0925 0.528 0.6648
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0099 0.0403 0.0442
Brugia malayi exodeoxyribonuclease III family protein 0.0099 0.0403 0.0403
Plasmodium vivax unspecified product 0.027 0.1416 0.1728
Giardia lamblia Hypothetical protein 0.027 0.1416 0.3476
Echinococcus multilocularis cathepsin L 0.027 0.1416 0.1385
Plasmodium falciparum thioredoxin reductase 0.0048 0.0103 0.0059
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0717 0.4051 0.5083
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0925 0.528 0.6648
Plasmodium vivax serine-repeat antigen 4 (SERA), putative 0.027 0.1416 0.1728
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.0469 0.0527
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.096 0.5486 0.6917
Echinococcus multilocularis lamin dm0 0.0057 0.0157 0.0122
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0099 0.0403 0.0442
Plasmodium falciparum serine repeat antigen 3 0.027 0.1416 0.1728
Trypanosoma cruzi PAB1-binding protein , putative 0.0082 0.0301 0.0313
Brugia malayi Cathepsin L-like precursor 0.0925 0.528 0.528
Trypanosoma cruzi cysteine peptidase, putative 0.0446 0.2454 0.3052
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.004 0.0057 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.027 0.1416 0.1731
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0484 0.2675 0.3332
Loa Loa (eye worm) hypothetical protein 0.0925 0.528 0.528
Plasmodium falciparum cysteine proteinase falcipain 1 0.0717 0.4051 0.5082
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Trichomonas vaginalis Clan CA, family C1, cathepsin H-like cysteine peptidase 0.027 0.1416 0.1731
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.0469 0.0527
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Trichomonas vaginalis conserved hypothetical protein 0.027 0.1416 0.1731
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.0103 0.0059
Brugia malayi cathepsin F-like cysteine proteinase 0.0446 0.2454 0.2454
Plasmodium falciparum cysteine proteinase falcipain 2a 0.1371 0.7916 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.0103 0.0069
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0099 0.0403 0.0442
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0484 0.2675 0.3349
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0122 0.0541 1
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.0103 0.0103
Echinococcus multilocularis cathepsin l cysteine peptidase 0.1371 0.7916 0.7908
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.004 0.0057 0.0003
Plasmodium vivax vivapain-3 0.0717 0.4051 0.5082
Echinococcus granulosus cathepsin l1 0.1371 0.7916 0.7908
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0099 0.0403 0.0439
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.096 0.5486 0.6917
Schistosoma mansoni hypothetical protein 0.0715 0.4042 0.5085
Leishmania major ubiquitin-conjugating enzyme e2, putative 0.004 0.0057 0.0003
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0099 0.0403 0.0369
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Loa Loa (eye worm) transcription factor SMAD2 0.025 0.1297 0.1297
Trypanosoma cruzi cysteine peptidase, putative 0.1371 0.7916 1
Giardia lamblia Cathepsin B precursor 0.027 0.1416 0.3476
Echinococcus granulosus geminin 0.0715 0.4042 0.4021
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.011 0.0469 0.1056
Mycobacterium tuberculosis Probable reductase 0.011 0.0468 0.1054
Trypanosoma cruzi cysteine peptidase, putative 0.1371 0.7916 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.03 0.1587 0.1587
Loa Loa (eye worm) glutathione reductase 0.0048 0.0103 0.0103
Loa Loa (eye worm) hypothetical protein 0.0057 0.0157 0.0157
Schistosoma mansoni DNA polymerase eta 0.004 0.0055 0.0025
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0209 0.022
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.0469 0.0527
Trichomonas vaginalis ap endonuclease, putative 0.0099 0.0403 0.0442
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Echinococcus granulosus cysteine protease 0.0717 0.4051 0.403
Brugia malayi Cathepsin L-like precursor 0.1371 0.7916 0.7916
Giardia lamblia Cysteine protease 0.027 0.1416 0.3476
Plasmodium falciparum serine repeat antigen 1 0.027 0.1416 0.1728
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0717 0.4051 0.5083
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Echinococcus granulosus dna polymerase kappa 0.004 0.0055 0.002
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.004 0.0055 0.0055
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Schistosoma mansoni cathepsin F (C01 family) 0.1371 0.7916 1
Leishmania major hypothetical protein, conserved 0.0082 0.0301 0.0313
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.011 0.0469 0.0469
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0099 0.0403 0.0439
Loa Loa (eye worm) MH2 domain-containing protein 0.025 0.1297 0.1297
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Echinococcus granulosus cathepsin l1 0.0925 0.528 0.5264
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0057 0.0157 0.0157
Echinococcus granulosus survival motor neuron protein 1 0.0241 0.1241 0.121
Toxoplasma gondii exonuclease III APE 0.0099 0.0403 0.0439
Plasmodium falciparum serine repeat antigen 2 0.027 0.1416 0.1728
Trypanosoma cruzi cysteine peptidase, putative 0.0717 0.4051 0.5083
Mycobacterium tuberculosis Probable oxidoreductase 0.0122 0.0541 0.1239
Plasmodium vivax serine-repeat antigen (SERA) 0.027 0.1416 0.1728
Plasmodium vivax serine-repeat antigen (SERA), putative 0.027 0.1416 0.1728
Onchocerca volvulus 0.1371 0.7916 1
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.0469 0.0527
Echinococcus multilocularis lamin 0.0057 0.0157 0.0122
Echinococcus granulosus dna polymerase eta 0.004 0.0055 0.002
Schistosoma mansoni cathepsin C 0.027 0.1416 0.1752
Echinococcus multilocularis cathepsin b 0.096 0.5486 0.547
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Loa Loa (eye worm) beta-lactamase 0.011 0.0469 0.0469
Leishmania major trypanothione reductase 0.0048 0.0103 0.0061
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0717 0.4051 0.5096
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.027 0.1416 0.1416
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Onchocerca volvulus 0.1371 0.7916 1
Brugia malayi Papain family cysteine protease containing protein 0.0717 0.4051 0.4051
Echinococcus granulosus tar DNA binding protein 0.0066 0.0209 0.0174
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0446 0.2454 0.2454
Echinococcus multilocularis cysteine protease 0.1371 0.7916 0.7908
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.0103 0.0061
Plasmodium falciparum ataxin-2 like protein, putative 0.0082 0.0301 0.031
Echinococcus granulosus cathepsin L 0.0717 0.4051 0.403
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Onchocerca volvulus 0.0057 0.0157 0.0062
Entamoeba histolytica cysteine protease, putative 0.027 0.1416 0.1731
Loa Loa (eye worm) hypothetical protein 0.011 0.0469 0.0469
Trypanosoma cruzi cysteine proteinase, putative 0.0717 0.4051 0.5083
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.027 0.1416 0.1728
Plasmodium falciparum cysteine proteinase falcipain 2b 0.1371 0.7916 1
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Echinococcus granulosus cathepsin L cysteine proteinase 0.1371 0.7916 0.7908
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0099 0.0403 0.0442
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0484 0.2675 0.3332
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.017 0.0135
Mycobacterium tuberculosis Probable esterase LipL 0.011 0.0469 0.1056
Mycobacterium tuberculosis Conserved protein 0.011 0.0469 0.1056
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.004 0.0057 0.0057
Entamoeba histolytica cysteine protease, putative 0.1371 0.7916 1
Giardia lamblia Cathepsin B precursor 0.027 0.1416 0.3476
Trypanosoma cruzi cruzipain precursor, putative 0.0446 0.2454 0.3052
Schistosoma mansoni hypothetical protein 0.03 0.1587 0.197
Leishmania major cysteine peptidase A (CPA) 0.1371 0.7916 1
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0484 0.2675 0.3332
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Schistosoma mansoni ubiquitin conjugating enzyme 13 0.004 0.0057 0.0028
Toxoplasma gondii cathepsin CPC2 0.027 0.1416 0.1728
Giardia lamblia Cysteine protease 0.027 0.1416 0.3476
Loa Loa (eye worm) hypothetical protein 0.1371 0.7916 0.7916
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Mycobacterium ulcerans lipase LipD 0.011 0.0469 1
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.0469 0.0527
Treponema pallidum exodeoxyribonuclease (exoA) 0.0099 0.0403 0.5
Trichomonas vaginalis ap endonuclease, putative 0.0099 0.0403 0.0442
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0209 0.022
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Loa Loa (eye worm) hypothetical protein 0.027 0.1416 0.1416
Giardia lamblia DNA repair protein RAD52 0.0703 0.3969 1
Entamoeba histolytica papain family cysteine protease domain containing protein 0.027 0.1416 0.1731
Schistosoma mansoni cathepsin S (C01 family) 0.027 0.1416 0.1752
Echinococcus granulosus snurportin 1 0.03 0.1587 0.1558
Brugia malayi Cathepsin L-like precursor 0.0446 0.2454 0.2454
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.027 0.1416 0.1731
Giardia lamblia Encystation-specific protease 0.027 0.1416 0.3476
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.027 0.1416 0.1752
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0209 0.022
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Brugia malayi ImpB/MucB/SamB family protein 0.004 0.0055 0.0055
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0209 0.0209
Onchocerca volvulus 0.0925 0.528 0.6625
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.017 0.2766
Schistosoma mansoni cathepsin s 0.0446 0.2454 0.3069
Trypanosoma cruzi cruzipain precursor, putative 0.1371 0.7916 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.017 0.0146
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0099 0.0403 0.5
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.017 0.2766
Trypanosoma cruzi cysteine peptidase, putative 0.1371 0.7916 1
Toxoplasma gondii cathepsin CPL 0.1371 0.7916 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.011 0.0468 0.1054
Onchocerca volvulus Cathepsin L homolog 0.1371 0.7916 1
Loa Loa (eye worm) RNA binding protein 0.0066 0.0209 0.0209
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0717 0.4051 0.5083
Mycobacterium tuberculosis Probable lipase LipD 0.011 0.0469 0.1056
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.011 0.0469 0.0469
Brugia malayi Ubiquitin conjugating enzyme protein 13 0.004 0.0057 0.0057
Toxoplasma gondii cathepsin CPC1 0.027 0.1416 0.1728
Echinococcus multilocularis cathepsin l cysteine peptidase 0.1371 0.7916 0.7908
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.027 0.1416 0.1728
Plasmodium falciparum serine repeat antigen 7 0.027 0.1416 0.1728
Echinococcus granulosus cathepsin L 0.027 0.1416 0.1385
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.027 0.1416 0.1731
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Giardia lamblia Hypothetical protein 0.027 0.1416 0.3476
Mycobacterium ulcerans esterase/lipase LipP 0.011 0.0469 1
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.027 0.1416 0.1752
Entamoeba histolytica cysteine proteinase, putative 0.0717 0.4051 0.5083
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.027 0.1416 0.1728
Echinococcus granulosus beta LACTamase domain containing family member 0.011 0.0469 0.0436
Mycobacterium tuberculosis Probable conserved lipoprotein 0.011 0.0469 0.1056
Brugia malayi RNA, U transporter 1 0.008 0.029 0.029
Mycobacterium tuberculosis Probable dehydrogenase 0.011 0.0468 0.1054
Brugia malayi Papain family cysteine protease containing protein 0.0717 0.4051 0.4051
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.027 0.1416 0.1731
Plasmodium falciparum glutathione reductase 0.0048 0.0103 0.0059
Echinococcus multilocularis dna polymerase kappa 0.004 0.0055 0.002
Onchocerca volvulus 0.1371 0.7916 1
Mycobacterium leprae Probable lipase LipE 0.011 0.0469 0.0105
Loa Loa (eye worm) cathepsin B 0.0484 0.2675 0.2675
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0099 0.0403 0.0442
Schistosoma mansoni hypothetical protein 0.0049 0.0109 0.0093
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.004 0.0055 0.002
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.0109 0.0109
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.1371 0.7916 1
Giardia lamblia Dipeptidyl-peptidase I precursor 0.027 0.1416 0.3476
Brugia malayi beta-lactamase family protein 0.011 0.0469 0.0469
Onchocerca volvulus Cathepsin L homolog 0.027 0.1416 0.1674
Giardia lamblia Dipeptidyl-peptidase I precursor 0.027 0.1416 0.3476
Schistosoma mansoni lamin 0.0057 0.0157 0.0155
Loa Loa (eye worm) fibroinase 0.1371 0.7916 0.7916
Trypanosoma cruzi cysteine proteinase, putative 0.0717 0.4051 0.5083
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0099 0.0403 0.0403
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.096 0.5486 0.6917
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Trypanosoma cruzi cysteine protease, putative 0.0717 0.4051 0.5083
Plasmodium vivax serine-repeat antigen (SERA) 0.027 0.1416 0.1728
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0099 0.0403 0.839
Brugia malayi cathepsin L-like precursor 0.0925 0.528 0.528
Onchocerca volvulus 0.1371 0.7916 1
Toxoplasma gondii cathepsin B 0.0484 0.2675 0.3331
Mycobacterium ulcerans beta-lactamase 0.011 0.0469 1
Loa Loa (eye worm) hypothetical protein 0.0925 0.528 0.528
Entamoeba histolytica cysteine proteinase 1, putative 0.0717 0.4051 0.5083
Giardia lamblia Cathepsin L precursor 0.027 0.1416 0.3476
Entamoeba histolytica ubiquitin-conjugating enzyme family protein 0.004 0.0057 0.0003
Loa Loa (eye worm) hypothetical protein 0.0925 0.528 0.528
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.1371 0.7916 1
Plasmodium falciparum serine repeat antigen 5 0.027 0.1416 0.1728
Echinococcus multilocularis cathepsin b 0.096 0.5486 0.547
Loa Loa (eye worm) intermediate filament protein 0.0057 0.0157 0.0157
Brugia malayi intermediate filament protein 0.0057 0.0157 0.0157
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.096 0.5486 0.691
Brugia malayi cathepsin F-like cysteine proteinase 0.027 0.1416 0.1416
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Echinococcus multilocularis snurportin 1 0.03 0.1587 0.1558
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0925 0.528 0.6648
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0703 0.3969 0.4979
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.1371 0.7916 0.7916
Onchocerca volvulus 0.011 0.0469 0.0462
Echinococcus granulosus cathepsin L cysteine protease 0.0717 0.4051 0.403
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.027 0.1416 0.1731
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.011 0.0469 1
Onchocerca volvulus 0.027 0.1416 0.1674
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.017 0.0171
Brugia malayi Intermediate filament tail domain containing protein 0.0057 0.0157 0.0157
Toxoplasma gondii preprocathepsin c precursor, putative 0.027 0.1416 0.1728
Onchocerca volvulus 0.1371 0.7916 1
Schistosoma mansoni hypothetical protein 0.0715 0.4042 0.5085
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.1371 0.7916 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.004 0.0055 0.0025
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.02 0.0999 0.1201
Entamoeba histolytica cysteine protease, putative 0.0717 0.4051 0.5083
Plasmodium falciparum serine repeat antigen 8 0.027 0.1416 0.1728
Trichomonas vaginalis esterase, putative 0.011 0.0469 0.0527
Echinococcus multilocularis cathepsin L cysteine protease 0.1371 0.7916 0.7908
Onchocerca volvulus 0.0057 0.0157 0.0062
Giardia lamblia Cysteine protease 0.027 0.1416 0.3476
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0925 0.528 0.6648
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.1371 0.7916 1
Leishmania major cathepsin L-like protease 0.1371 0.7916 1
Plasmodium vivax unspecified product 0.0446 0.2454 0.305
Echinococcus multilocularis microtubule associated protein 2 0.0732 0.414 0.412
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.027 0.1416 0.1752

Activities

Activity type Activity value Assay description Source Reference
GC50 (functional) = 60.1 uM Cytotoxicity against TrxR overexpressing human A549 cells after 48 hrs by MTT assay ChEMBL. 18678491

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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