TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 549.598 | Formula: C27H27N5O6S
H donors: 1 H acceptors: 7 LogP: 2.72 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: CCC(C(=O)c1nc2c(o1)cccc2)NC(=O)[C@@H]1C[C@H](CN1C(=O)C)S(=O)(=O)c1ccc(cc1)n1cccn1
InChi: 1S/C27H27N5O6S/c1-3-21(25(34)27-30-22-7-4-5-8-24(22)38-27)29-26(35)23-15-20(16-31(23)17(2)33)39(36,37)19-11-9-18(10-12-19)32-14-6-13-28-32/h4-14,20-21,23H,3,15-16H2,1-2H3,(H,29,35)/t20-,21?,23+/m1/s1
InChiKey: TXLOVXMRCXNWCJ-LYLQVHRMSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cathepsin S	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania mexicana		Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana	cathepsin L-like protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Entamoeba histolytica	cysteine protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Entamoeba histolytica	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium berghei	berghepain-2	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Cryptosporidium parvum	cryptopain - cysteine proteinase secreted, possible transmembrane domain near N-terminus	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium yoelii	berghepain-2	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cysteine protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cysteine peptidase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine proteinase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana	cathepsin L-like protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cysteine protease	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	ctsf protein	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium knowlesi	knowpain-3	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus granulosus	cathepsin l1	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei gambiense	cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus granulosus	cathepsin L cysteine proteinase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana	cysteine peptidase A (CBA)	Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma mansoni	cathepsin F (C01 family)	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus	Cathepsin L homolog	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium falciparum	cysteine proteinase falcipain 2b	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei gambiense	cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	fibroinase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma japonicum	expressed protein	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania infantum	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium knowlesi	knowpain-2	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma mansoni	cathepsin F (C01 family)	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana		Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Papain family cysteine protease containing protein	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma japonicum	Cathepsin L-like proteinase precursor, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium falciparum	cysteine proteinase falcipain 2a	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana		Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania braziliensis	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania braziliensis	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium vivax	vivapain-2	Get druggable targets OG5_126607	All targets in OG5_126607
Neospora caninum	Cathepsin L, related	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium vivax	vivapain-2	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	papain family cysteine protease containing protein	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium knowlesi	knowpain-4	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania infantum	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Cryptosporidium hominis	cryptopain precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cysteine peptidase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cathepsin l cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus	Cathepsin L homolog	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine protease, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus granulosus	cathepsin l1	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cysteine peptidase A (CPA)	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana		Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma japonicum	ko:K01373 cathepsin F [EC3.4.22.41], putative	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus granulosus	cathepsin l cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania braziliensis	cysteine peptidase A (CPA)	Get druggable targets OG5_126607	All targets in OG5_126607
Plasmodium falciparum	cysteine proteinase falcipain 3	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cysteine peptidase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Entamoeba histolytica	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cathepsin L cysteine protease	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania donovani	cysteine peptidase A (CBA)	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cysteine peptidase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Theileria parva	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Toxoplasma gondii	cathepsin CPL	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cathepsin L cysteine protease	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania braziliensis	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma cruzi	cruzipain precursor, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania major	cathepsin L-like protease	Get druggable targets OG5_126607	All targets in OG5_126607
Echinococcus multilocularis	cathepsin l cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Brugia malayi	Cathepsin L-like cysteine proteinase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana		Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania infantum	cysteine peptidase A (CPA)	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Entamoeba histolytica	cysteine proteinase, putative	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Schistosoma mansoni	cathepsin F (C01 family)	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus	Cathepsin F homolog	Get druggable targets OG5_126607	All targets in OG5_126607
Loa Loa (eye worm)	cysteine protease	Get druggable targets OG5_126607	All targets in OG5_126607
Onchocerca volvulus		Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma brucei gambiense	cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trypanosoma congolense	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	Get druggable targets OG5_126607	All targets in OG5_126607

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	cysteine proteinase falcipain 1	cathepsin S	281 aa	226 aa	34.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	histone deacetylase 1	0.0148	0.098	0.098
Echinococcus granulosus	carboxylesterase 5A	0.1342	1	1
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Loa Loa (eye worm)	hypothetical protein	0.1342	1	1
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0148	0.098	0.6217
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0067	0.0687
Echinococcus multilocularis	histone deacetylase 8	0.0055	0.0282	0.0216
Brugia malayi	Carboxylesterase family protein	0.0227	0.1576	0.1576
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Onchocerca volvulus		0.0027	0.0067	0.0427
Giardia lamblia	Histone deacetylase	0.0148	0.098	0.5
Onchocerca volvulus		0.0227	0.1576	1
Onchocerca volvulus		0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Brugia malayi	Carboxylesterase family protein	0.0227	0.1576	0.1576
Trypanosoma brucei	histone deacetylase 2	0.0055	0.0282	0.2349
Schistosoma mansoni	cathepsin F (C01 family)	0.0027	0.0067	0.0067
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0067	0.0687
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Mycobacterium ulcerans	carboxylesterase, LipT	0.0227	0.1576	0.5
Loa Loa (eye worm)	histone deacetylase	0.0055	0.0282	0.0282
Echinococcus multilocularis	histone deacetylase 1	0.0148	0.098	0.0919
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Echinococcus granulosus	neuroligin	0.0227	0.1576	0.1576
Echinococcus granulosus	para nitrobenzyl esterase	0.0227	0.1576	0.1576
Brugia malayi	Carboxylesterase family protein	0.0227	0.1576	0.1576
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Echinococcus granulosus	histone deacetylase 6	0.0055	0.0282	0.0282
Onchocerca volvulus		0.0227	0.1576	1
Toxoplasma gondii	histone deacetylase HDAC5	0.0055	0.0282	0.2349
Schistosoma mansoni	histone deacetylase	0.0148	0.098	0.098
Schistosoma mansoni	acetylcholinesterase	0.0227	0.1576	0.1576
Brugia malayi	Histone deacetylase family protein	0.0055	0.0282	0.0282
Brugia malayi	Papain family cysteine protease containing protein	0.0027	0.0067	0.0067
Echinococcus multilocularis	nuclear receptor co repressor related (ncor)	0.028	0.1978	0.1924
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0227	0.1576	0.5
Plasmodium falciparum	histone deacetylase 1	0.0148	0.098	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0027	0.0067	0.0067
Loa Loa (eye worm)	acetylcholinesterase 1	0.1342	1	1
Toxoplasma gondii	histone deacetylase HDAC3	0.0148	0.098	1
Echinococcus multilocularis	histone deacetylase 3	0.0148	0.098	0.0919
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Loa Loa (eye worm)	histone deacetylase 11	0.0055	0.0282	0.0282
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Onchocerca volvulus		0.0227	0.1576	1
Trypanosoma brucei	histone deacetylase, putative	0.0055	0.0282	0.2349
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0148	0.098	0.6217
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0227	0.1576	0.1519
Echinococcus multilocularis	neuroligin	0.0227	0.1576	0.1519
Echinococcus multilocularis	acetylcholinesterase	0.1342	1	1
Echinococcus granulosus	acetylcholinesterase	0.1342	1	1
Echinococcus multilocularis	histone deacetylase 6	0.0055	0.0282	0.0216
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.1342	1	1
Echinococcus multilocularis	histone deacetylase 7	0.0055	0.0282	0.0216
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0227	0.1576	0.1576
Onchocerca volvulus	Cathepsin F homolog	0.0027	0.0067	0.0427
Plasmodium vivax	histone deacetylase 2, putative	0.0055	0.0282	0.2349
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0227	0.1576	1
Echinococcus granulosus	cathepsin l1	0.0027	0.0067	0.0067
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0067	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0067	0.0067
Toxoplasma gondii	histone deacetylase HDAC4	0.0055	0.0282	0.2349
Schistosoma mansoni	histone deacetylase 4 5	0.0055	0.0282	0.0282
Onchocerca volvulus		0.0027	0.0067	0.0427
Onchocerca volvulus		0.0027	0.0067	0.0427
Trypanosoma cruzi	histone deacetylase, putative	0.0055	0.0282	0.2874
Trypanosoma cruzi	histone deacetylase 1, putative	0.0148	0.098	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Echinococcus granulosus	histone deacetylase 6	0.0055	0.0282	0.0282
Echinococcus granulosus	histone deacetylase 3	0.0148	0.098	0.098
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Loa Loa (eye worm)	histone deacetylase 7A	0.0055	0.0282	0.0282
Leishmania major	histone deacetylase, putative	0.0055	0.0282	0.2349
Loa Loa (eye worm)	carboxylesterase	0.0227	0.1576	0.1576
Onchocerca volvulus	Cathepsin L homolog	0.0027	0.0067	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0148	0.098	0.098
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0282	0.0282
Schistosoma mansoni	BC026374 protein (S09 family)	0.0227	0.1576	0.1576
Onchocerca volvulus		0.0027	0.0067	0.0427
Loa Loa (eye worm)	histone deacetylase 3	0.0148	0.098	0.098
Schistosoma mansoni	histone deacetylase 4 5	0.0055	0.0282	0.0282
Onchocerca volvulus		0.0227	0.1576	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0067	0.0687
Leishmania major	histone deacetylase, putative	0.0148	0.098	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Schistosoma mansoni	gliotactin	0.0227	0.1576	0.1576
Echinococcus granulosus	BC026374 protein S09 family	0.0227	0.1576	0.1576
Toxoplasma gondii	histone deacetylase HDAC2	0.0148	0.098	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Leishmania major	histone deacetylase, putative	0.0055	0.0282	0.2349
Echinococcus multilocularis	carboxylesterase 5A	0.1342	1	1
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Echinococcus granulosus	nuclear receptor co repressor related ncor	0.028	0.1978	0.1978
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0067	0.0687
Onchocerca volvulus		0.0027	0.0067	0.0427
Loa Loa (eye worm)	hypothetical protein	0.1342	1	1
Loa Loa (eye worm)	histone deacetylase 1	0.0148	0.098	0.098
Brugia malayi	histone deacetylase 3 (HD3)	0.0148	0.098	0.098
Brugia malayi	hypothetical protein	0.0227	0.1576	0.1576
Brugia malayi	Carboxylesterase family protein	0.0227	0.1576	0.1576
Onchocerca volvulus	Histone deacetylase 10 homolog	0.0055	0.0282	0.1787
Echinococcus granulosus	histone deacetylase 6	0.0055	0.0282	0.0282
Echinococcus multilocularis	histone deacetylase	0.0055	0.0282	0.0216
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Trypanosoma cruzi	cruzipain precursor, putative	0.0027	0.0067	0.0687
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0227	0.1576	0.1576
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Trypanosoma brucei	histone deacetylase 4	0.0055	0.0282	0.2349
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0227	0.1576	0.1519
Echinococcus multilocularis	acetylcholinesterase	0.1342	1	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0227	0.1576	0.1576
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Loa Loa (eye worm)	carboxylesterase	0.1342	1	1
Trichomonas vaginalis	spcc417.12 protein, putative	0.0227	0.1576	1
Schistosoma mansoni	histone deacetylase hda2	0.0055	0.0282	0.0282
Schistosoma mansoni	histone deacetylase	0.0148	0.098	0.098
Plasmodium vivax	histone deacetylase, putative	0.0055	0.0282	0.2349
Trypanosoma cruzi	histone deacetylase 1, putative	0.0148	0.098	1
Brugia malayi	histone deacetylase 1 (HD1)	0.0148	0.098	0.098
Trypanosoma brucei	histone deacetylase 1	0.0148	0.098	1
Plasmodium vivax	histone deacetylase 1, putative	0.0148	0.098	1
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Onchocerca volvulus		0.0027	0.0067	0.0427
Trypanosoma brucei	histone deacetylase 3	0.0055	0.0282	0.2349
Plasmodium vivax	histone deacetylase, putative	0.0055	0.0282	0.2349
Trypanosoma cruzi	histone deacetylase, putative	0.0055	0.0282	0.2874
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0027	0.0067	0.0067
Onchocerca volvulus		0.0227	0.1576	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Loa Loa (eye worm)	cysteine protease	0.0027	0.0067	0.0067
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0227	0.1576	0.1576
Leishmania major	histone deacetylase, putative	0.0148	0.098	1
Echinococcus multilocularis	histone deacetylase 6	0.0055	0.0282	0.0216
Schistosoma mansoni	histone deacetylase hda2	0.0055	0.0282	0.0282
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0027	0.0067	0.0427
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0027	0.0067	0.0067
Plasmodium falciparum	histone deacetylase, putative	0.0055	0.0282	0.2349
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Echinococcus granulosus	acetylcholinesterase	0.1342	1	1
Entamoeba histolytica	histone deacetylase, putative	0.0148	0.098	1
Echinococcus multilocularis	histone deacetylase 6	0.0055	0.0282	0.0216
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0027	0.0067	0.0067
Trypanosoma cruzi	histone deacetylase, putative	0.0055	0.0282	0.2874
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Loa Loa (eye worm)	carboxylesterase	0.0227	0.1576	0.1576
Schistosoma mansoni	histone deacetylase 1 2 3	0.0055	0.0282	0.0282
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0027	0.0067	0.0427
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Brugia malayi	Histone deacetylase family protein	0.0055	0.0282	0.0282
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0067	0.0687
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Echinococcus granulosus	histone deacetylase	0.0055	0.0282	0.0282
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Loa Loa (eye worm)	ctsf protein	0.0027	0.0067	0.0067
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0148	0.098	0.6217
Brugia malayi	Histone deacetylase 1	0.0148	0.098	0.098
Trichomonas vaginalis	histone deacetylase, putative	0.0148	0.098	0.6217
Brugia malayi	histone deacetylase 11	0.0055	0.0282	0.0282
Toxoplasma gondii	histone deacetylase HDAC1	0.0055	0.0282	0.2349
Schistosoma mansoni	cathepsin F (C01 family)	0.0027	0.0067	0.0067
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0227	0.1576	0.5
Loa Loa (eye worm)	fibroinase	0.0027	0.0067	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0067	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0227	0.1576	0.1576
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0067	0.0427
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0227	0.1576	0.5
Trypanosoma cruzi	histone deacetylase, putative	0.0055	0.0282	0.2874
Plasmodium falciparum	histone deacetylase 2	0.0055	0.0282	0.2349
Brugia malayi	Cathepsin L-like precursor	0.0027	0.0067	0.0067
Onchocerca volvulus	Cathepsin L homolog	0.0027	0.0067	0.0427
Echinococcus granulosus	histone deacetylase 7	0.0055	0.0282	0.0282
Echinococcus granulosus	histone deacetylase 8	0.0055	0.0282	0.0282
Brugia malayi	Carboxylesterase family protein	0.1342	1	1
Trypanosoma cruzi	histone deacetylase, putative	0.0055	0.0282	0.2874
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0227	0.1576	0.1576
Echinococcus multilocularis	para nitrobenzyl esterase	0.0227	0.1576	0.1519

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 3.2 nM	Inhibition of human cathepsin-S	ChEMBL.	23639544

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

ChEMBL: CHEMBL2380729

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1764059