Detailed information for compound 58255

Basic information

Technical information
  • TDR Targets ID: 58255
  • Name: 1,3,8-trimethoxy-6-methylanthracene-9,10-dion e
  • MW: 312.317 | Formula: C18H16O5
  • H donors: 0 H acceptors: 2 LogP: 3.15 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(OC)c2c(c1)C(=O)c1c(C2=O)c(OC)cc(c1)C
  • InChi: 1S/C18H16O5/c1-9-5-11-15(13(6-9)22-3)18(20)16-12(17(11)19)7-10(21-2)8-14(16)23-4/h5-8H,1-4H3
  • InChiKey: HICKZJMJOXACIR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1,3,8-trimethoxy-6-methyl-anthracene-9,10-dione
  • 1,3,8-trimethoxy-6-methyl-9,10-anthraquinone
  • ZINC04716484

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
Entamoeba histolytica cysteine proteinase, putative 0.021 0.0465 0.4054
Schistosoma mansoni cathepsin B (C01 family) 0.0092 0.0065 0.0065
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221
Loa Loa (eye worm) hypothetical protein 0.0179 0.0362 0.1239
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Echinococcus granulosus aminopeptidase N 0.0292 0.0742 0.2375
Onchocerca volvulus 0.0383 0.1051 1
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Entamoeba histolytica cysteine proteinase, putative 0.021 0.0465 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0092 0.0065 0.0221
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0933 0.2918 0.2918
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Brugia malayi hypothetical protein 0.0228 0.0525 0.1614
Schistosoma mansoni cathepsin F (C01 family) 0.0383 0.1051 0.1051
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0092 0.0065 0.0065
Schistosoma mansoni cathepsin F (C01 family) 0.0265 0.0651 0.0651
Brugia malayi Cathepsin L-like precursor 0.0265 0.0651 0.2056
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0118 0.0153 0.0524
Trypanosoma cruzi cysteine peptidase, putative 0.0383 0.1051 0.3602
Onchocerca volvulus 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Echinococcus granulosus cathepsin l1 0.0383 0.1051 0.3457
Schistosoma mansoni cathepsin F (C01 family) 0.0383 0.1051 0.1051
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221
Giardia lamblia Cathepsin B precursor 0.0352 0.0947 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0383 0.1051 1
Echinococcus granulosus cathepsin b 0.0933 0.2918 1
Brugia malayi Peptidase family M1 containing protein 0.0112 0.0134 0.0243
Brugia malayi cathepsin L-like precursor 0.0265 0.0651 0.2056
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0092 0.0065 0.0221
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0582 0.1729 0.5924
Plasmodium vivax vivapain-1 0.021 0.0465 0.4054
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0298 0.0763 0.7084
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0112 0.0134 0.0134
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0383 0.1051 0.3602
Onchocerca volvulus Cathepsin L homolog 0.0383 0.1051 1
Echinococcus granulosus Lysosomal Pro X carboxypeptidase 0.0826 0.2556 0.8732
Echinococcus multilocularis aminopeptidase N 0.0292 0.0742 0.2544
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.021 0.0465 0.4054
Loa Loa (eye worm) hypothetical protein 0.0355 0.0957 0.3278
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0265 0.0651 0.5946
Echinococcus granulosus cysteine protease 0.021 0.0465 0.1402
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trypanosoma cruzi cysteine proteinase, putative 0.021 0.0465 0.1592
Leishmania major cysteine peptidase A (CPA) 0.0383 0.1051 0.5751
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0092 0.0065 0.0065
Echinococcus multilocularis cysteine protease 0.0383 0.1051 0.3602
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.021 0.0465 0.4054
Loa Loa (eye worm) cysteine protease 0.0383 0.1051 0.3602
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Brugia malayi follicle stimulating hormone receptor 0.0224 0.0514 0.1576
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0383 0.1051 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Giardia lamblia Cathepsin B precursor 0.0352 0.0947 1
Loa Loa (eye worm) hypothetical protein 0.0252 0.0608 0.2085
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Echinococcus multilocularis cathepsin b 0.0933 0.2918 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0092 0.0065 0.0065
Brugia malayi Peptidase family M1 containing protein 0.0292 0.0742 0.2375
Brugia malayi cathepsin B-like cysteine proteinase 0.0933 0.2918 1
Brugia malayi Papain family cysteine protease containing protein 0.0383 0.1051 0.3457
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0582 0.1729 0.1729
Entamoeba histolytica cysteine proteinase 2 0.021 0.0465 0.4054
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Plasmodium vivax vivapain-2 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0383 0.1051 0.3602
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Toxoplasma gondii cathepsin B 0.0352 0.0947 0.8946
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0112 0.0134 0.0702
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0582 0.1729 1
Brugia malayi Cathepsin L-like precursor 0.0118 0.0153 0.031
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0549 0.1616 0.1616
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Brugia malayi Cathepsin L-like precursor 0.0265 0.0651 0.2056
Loa Loa (eye worm) aminopeptidase N 0.0112 0.0134 0.0459
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0383 0.1051 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0383 0.1051 0.3602
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.021 0.0465 0.0465
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0112 0.0134 0.0243
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0582 0.1729 0.5924
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Onchocerca volvulus 0.0112 0.0134 0.0702
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0352 0.0947 0.3246
Entamoeba histolytica cysteine proteinase 1, putative 0.021 0.0465 0.4054
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.021 0.0465 0.2073
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0092 0.0065 0.0065
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0224 0.0514 0.1762
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0298 0.0763 0.0763
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.012 0.0159 0.0159
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0383 0.1051 0.3602
Giardia lamblia Cathepsin B precursor 0.0352 0.0947 1
Brugia malayi cathepsin F-like cysteine proteinase 0.0118 0.0153 0.031
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0092 0.0065 0.0221
Trypanosoma cruzi major cysteine proteinase, putative 0.0092 0.0065 0.0221
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Plasmodium vivax unspecified product 0.0118 0.0153 0.0896
Loa Loa (eye worm) hypothetical protein 0.0265 0.0651 0.2232
Loa Loa (eye worm) ctsf protein 0.0383 0.1051 0.3602
Trypanosoma cruzi cruzipain precursor, putative 0.0383 0.1051 0.3602
Onchocerca volvulus 0.0383 0.1051 1
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0933 0.2918 0.2918
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Trypanosoma cruzi Aminopeptidase M1, putative 0.0112 0.0134 0.0459
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0582 0.1729 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.0153 0.0524
Entamoeba histolytica cysteine protease, putative 0.0383 0.1051 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.0265 0.0651 0.2056
Entamoeba histolytica aminopeptidase, putative 0.0112 0.0134 0.0702
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221
Plasmodium falciparum cysteine proteinase falcipain 1 0.021 0.0465 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0092 0.0065 0.0065
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Onchocerca volvulus 0.0383 0.1051 1
Loa Loa (eye worm) peptidase family M1 containing protein 0.0219 0.0495 0.1698
Echinococcus granulosus cathepsin b 0.0933 0.2918 1
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0298 0.0763 0.2449
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Trypanosoma cruzi major cysteine proteinase, putative 0.0092 0.0065 0.0221
Entamoeba histolytica cysteine proteinase, putative 0.021 0.0465 0.4054
Echinococcus granulosus cathepsin L cysteine protease 0.021 0.0465 0.1402
Echinococcus multilocularis cathepsin b 0.0933 0.2918 1
Brugia malayi Papain family cysteine protease containing protein 0.021 0.0465 0.1402
Trypanosoma cruzi aminopeptidase, putative 0.0112 0.0134 0.0459
Echinococcus granulosus cathepsin l cysteine peptidase 0.0383 0.1051 0.3457
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0582 0.1729 1
Echinococcus multilocularis cathepsin L 0.0092 0.0065 0.0221
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0265 0.0651 0.5946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Trypanosoma cruzi cysteine peptidase, putative 0.0383 0.1051 0.3602
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0112 0.0134 0.0243
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0933 0.2918 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0112 0.0134 0.0243
Trypanosoma cruzi cysteine protease, putative 0.021 0.0465 0.1592
Loa Loa (eye worm) hypothetical protein 0.0265 0.0651 0.2232
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Brugia malayi prolyl oligopeptidase family protein 0.0298 0.0763 0.2449
Loa Loa (eye worm) hypothetical protein 0.0933 0.2918 1
Loa Loa (eye worm) fibroinase 0.0383 0.1051 0.3602
Toxoplasma gondii cathepsin CPL 0.0383 0.1051 1
Trypanosoma cruzi cysteine peptidase, putative 0.0383 0.1051 0.3602
Loa Loa (eye worm) hypothetical protein 0.0118 0.0153 0.0524
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Echinococcus granulosus cathepsin L 0.021 0.0465 0.1402
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0112 0.0134 0.0702
Entamoeba histolytica cysteine proteinase, putative 0.0383 0.1051 1
Onchocerca volvulus 0.0383 0.1051 1
Schistosoma mansoni cathepsin C 0.0092 0.0065 0.0065
Loa Loa (eye worm) hypothetical protein 0.0228 0.0525 0.18
Echinococcus multilocularis cathepsin L cysteine protease 0.0383 0.1051 0.3602
Loa Loa (eye worm) hypothetical protein 0.0118 0.0153 0.0524
Entamoeba histolytica cysteine proteinase, putative 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0352 0.0947 0.8946
Echinococcus granulosus Dipeptidyl peptidase 9 0.0582 0.1729 0.5832
Entamoeba histolytica cysteine proteinase, putative 0.0265 0.0651 0.5946
Schistosoma mansoni subfamily C1A non-peptidase homologue (C01 family) 0.0092 0.0065 0.0065
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.021 0.0465 0.0465
Trypanosoma cruzi cysteine peptidase, putative 0.0383 0.1051 0.3602
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0112 0.0134 0.0243
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0112 0.0134 0.0459
Schistosoma mansoni cathepsin s 0.0118 0.0153 0.0153
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0298 0.0763 0.7084
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221
Plasmodium vivax vivapain-3 0.021 0.0465 0.4054
Brugia malayi prolyl oligopeptidase family protein 0.0582 0.1729 0.5832
Onchocerca volvulus Cathepsin L homolog 0.0383 0.1051 1
Trypanosoma cruzi cysteine peptidase, putative 0.0118 0.0153 0.0524
Echinococcus multilocularis Lysosomal Pro X carboxypeptidase 0.0826 0.2556 0.876
Onchocerca volvulus 0.0383 0.1051 1
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0112 0.0134 0.0459
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0118 0.0153 0.031
Loa Loa (eye worm) hypothetical protein 0.0383 0.1051 0.3602
Loa Loa (eye worm) cathepsin B 0.0352 0.0947 0.3246
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0582 0.1729 0.5924
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Onchocerca volvulus 0.0265 0.0651 0.5946
Loa Loa (eye worm) hypothetical protein 0.0265 0.0651 0.2232
Schistosoma mansoni cathepsin S (C01 family) 0.0092 0.0065 0.0065
Onchocerca volvulus 0.0292 0.0742 0.687
Echinococcus granulosus cathepsin l1 0.0265 0.0651 0.2056
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.021 0.0465 0.2073
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0092 0.0065 0.0065
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0298 0.0763 0.2616
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0265 0.0651 0.2232
Brugia malayi Papain family cysteine protease containing protein 0.021 0.0465 0.1402
Plasmodium vivax unspecified product 0.021 0.0465 0.4054
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0092 0.0065 0.0065
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0933 0.2918 0.2918
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0933 0.2918 0.2918
Onchocerca volvulus 0.0383 0.1051 1
Onchocerca volvulus Cathepsin F homolog 0.0383 0.1051 1
Brugia malayi hypothetical protein 0.0112 0.0134 0.0243
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Schistosoma mansoni family S28 unassigned peptidase (S28 family) 0.0826 0.2556 0.2556
Plasmodium vivax vivapain-2 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0298 0.0763 0.2616
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0352 0.0947 0.0947
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.021 0.0465 0.1592
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0112 0.0134 0.0459
Brugia malayi Cathepsin L-like precursor 0.0383 0.1051 0.3457
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.021 0.0465 0.0465
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0112 0.0134 0.0459
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0112 0.0134 0.0459
Echinococcus multilocularis cathepsin L 0.021 0.0465 0.1592
Trypanosoma cruzi cysteine proteinase, putative 0.021 0.0465 0.1592
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Leishmania major cathepsin L-like protease 0.0383 0.1051 0.5751
Trypanosoma cruzi cruzipain precursor, putative 0.0118 0.0153 0.0524
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0383 0.1051 1
Entamoeba histolytica cysteine proteinase, putative 0.021 0.0465 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Entamoeba histolytica cysteine protease, putative 0.021 0.0465 0.4054
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0383 0.1051 0.3602
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0383 0.1051 1
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.0092 0.0065 0.0065
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0383 0.1051 1
Echinococcus multilocularis cysteine protease 0.0383 0.1051 0.3602
Trypanosoma cruzi cysteine peptidase, putative 0.021 0.0465 0.1592
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0112 0.0134 0.0459
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0112 0.0134 0.0459
Trypanosoma brucei cysteine peptidase C (CPC) 0.0352 0.0947 0.5099
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0352 0.0947 0.5099
Mycobacterium ulcerans aminopeptidase N PepN 0.0112 0.0134 0.5
Echinococcus granulosus cathepsin L cysteine proteinase 0.0383 0.1051 0.3457
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0383 0.1051 0.5751
Loa Loa (eye worm) hypothetical protein 0.0092 0.0065 0.0221

Activities

Activity type Activity value Assay description Source Reference
Activity (ADMET) = 60 % Cytotoxicity against human Raji cells assessed as cell viability at 1000 molar ratio ChEMBL. 18556196
Control (functional) = 99.1 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 1 microM ChEMBL. 11459643
Control (functional) = 99.1 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 1 microM ChEMBL. 11459643
Control (functional) = 109.3 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 3 microM ChEMBL. 11459643
Control (functional) = 109.3 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 3 microM ChEMBL. 11459643
Control (functional) < 127.2 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 10 microM ChEMBL. 11459643
Control (functional) < 127.2 % Compound was tested for enhancement of proliferation of MCF-7 cell line at a concentration 10 microM ChEMBL. 11459643
ID50 (functional) = 0.000021 M Inhibitory activity against [3H]-TdR incorporation into DNA in HL-60 cells during the initial 30-min period . ChEMBL. 2738893
ID50 (functional) = 0.000049 M Inhibitory activity against human acute promyelocytic leukemia cells(HL-60) cell growth on 72 hr of exposure of the compound. ChEMBL. 2738893
ID50 (functional) = 0.000049 M Inhibitory activity against human acute promyelocytic leukemia cells(HL-60) cell growth on 72 hr of exposure of the compound. ChEMBL. 2738893
ID50 (functional) = 0.0001 M Inhibitory activity against murine L1210 leukemic cell growth ChEMBL. 2738893
ID50 (functional) = 0.0001 M Inhibitory activity against murine L1210 leukemic cell growth ChEMBL. 2738893
Inhibition (binding) % Inhibitory activity of the compound against Cathepsin G (CatG) at 30 microM concentration; NI = noinhibition ChEMBL. 1578486
Inhibition (binding) 0 % Inhibitory activity of the compound against Cathepsin G (CatG) at 30 microM concentration; NI = noinhibition ChEMBL. 1578486
Inhibition (binding) = 4 % Inhibitory activity of the compound against Porcine Pancreatic Elastase (PPE) at 30 microM concentration ChEMBL. 1578486
Inhibition (binding) = 4 % Inhibitory activity of the compound against Porcine Pancreatic Elastase (PPE) at 30 microM concentration ChEMBL. 1578486
Inhibition (binding) = 6 % Inhibitory activity of the compound against Chymotrypsinogen at 30 microM concentration ChEMBL. 1578486
Inhibition (binding) = 6 % Inhibitory activity of the compound against Chymotrypsinogen at 30 microM concentration ChEMBL. 1578486
Inhibition (binding) = 16 % Inhibitory activity of the compound against Human Leukocyte Elastase (HLE) at 30 microM concentration ChEMBL. 1578486
Inhibition (binding) = 16 % Inhibitory activity of the compound against Human Leukocyte Elastase (HLE) at 30 microM concentration ChEMBL. 1578486
Ratio (functional) = 0.43 Ratio for human acute promyelocytic leukemia cells(HL-60) cell growth inhibition and [3H]-TdR incorporation into DNA in HL-60 cells ChEMBL. 2738893

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

3 literature references were collected for this gene.

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