TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 407.295 | Formula: C22H16Cl2N4
H donors: 0 H acceptors: 3 LogP: 5.77 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: N#Cc1ncc2c(n1)n(CCc1ccc(cc1)Cl)c(c2)Cc1ccc(cc1)Cl
InChi: 1S/C22H16Cl2N4/c23-18-5-1-15(2-6-18)9-10-28-20(11-16-3-7-19(24)8-4-16)12-17-14-26-21(13-25)27-22(17)28/h1-8,12,14H,9-11H2
InChiKey: BJARUCXSUFPSCE-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cathepsin K	Starlite/ChEMBL	References
Homo sapiens	cathepsin L	Starlite/ChEMBL	References
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 infantum	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
Plasmodium knowlesi	knowpain-2	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
Loa Loa (eye worm)	hypothetical protein	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
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
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-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 congolense	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
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
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
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 braziliensis	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
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
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 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
Leishmania major	cathepsin L-like protease	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 major	cathepsin L-like protease	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
Plasmodium falciparum	cysteine proteinase falcipain 2a	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
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-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
Brugia malayi	Cathepsin L-like precursor	Get druggable targets OG5_126607	All targets in OG5_126607
Leishmania mexicana		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
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, cathepsin L-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, cathepsin L-like cysteine peptidase	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
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)	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
Entamoeba histolytica	cysteine proteinase, 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
Leishmania mexicana	cysteine peptidase A (CBA)	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 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
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
Echinococcus granulosus	cathepsin L 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 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
Leishmania mexicana		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
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)	hypothetical protein	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
Leishmania mexicana		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
Brugia malayi	Papain family cysteine protease containing protein	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
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
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	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 mexicana	cathepsin L-like protease, 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
Leishmania major	cathepsin L-like protease	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
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
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
Leishmania major	cysteine peptidase A (CPA)	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
Leishmania braziliensis	cathepsin L-like protease	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, 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
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, papain-like cysteine peptidase	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)	fibroinase	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
Entamoeba histolytica	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
Schistosoma mansoni	cathepsin F (C01 family)	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
Leishmania infantum	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
Echinococcus granulosus	cathepsin l1	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
Trypanosoma brucei	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
Onchocerca volvulus		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
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
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
Cryptosporidium hominis	cryptopain precursor	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
Leishmania major	cathepsin L-like 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 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
Echinococcus multilocularis	cathepsin l cysteine peptidase	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
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
Loa Loa (eye worm)	hypothetical protein	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
Theileria parva	cysteine protease, 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
Leishmania donovani	cysteine peptidase A (CBA)	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 cruzi	cysteine peptidase, 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
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 peptidase	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
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
Brugia malayi	Cathepsin L-like precursor	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
Schistosoma japonicum	ko:K01373 cathepsin F [EC3.4.22.41], 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
Echinococcus granulosus	cathepsin l 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 L	333 aa	359 aa	30.1 %
Plasmodium falciparum	cysteine proteinase falcipain 1	cathepsin K	329 aa	349 aa	33.2 %
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
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Loa Loa (eye worm)	carboxylesterase	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Loa Loa (eye worm)	hypothetical protein	0.1873	1	1
Schistosoma mansoni	acetylcholinesterase	0.0316	0.1442	0.1442
Schistosoma mansoni	calcium-activated potassium channel	0.0346	0.1607	0.1607
Schistosoma mansoni	cathepsin F (C01 family)	0.0081	0.0147	0.0147
Loa Loa (eye worm)	acetylcholinesterase 1	0.1873	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Loa Loa (eye worm)	fibroinase	0.0081	0.0147	0.0147
Brugia malayi	Carboxylesterase family protein	0.0316	0.1442	0.1442
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0316	0.1442	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0081	0.0147	1
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0024	0.0024
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0316	0.1442	0.1315
Brugia malayi	Carboxylesterase family protein	0.1873	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Echinococcus granulosus	para nitrobenzyl esterase	0.0316	0.1442	0.1442
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0316	0.1442	0.1315
Echinococcus granulosus	BC026374 protein S09 family	0.0316	0.1442	0.1442
Echinococcus multilocularis	acetylcholinesterase	0.1873	1	1
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Onchocerca volvulus		0.0081	0.0147	0.1019
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Echinococcus granulosus	choline:ethanolamine kinase	0.0221	0.0918	0.0918
Onchocerca volvulus		0.0081	0.0147	0.1019
Onchocerca volvulus		0.0081	0.0147	0.1019
Brugia malayi	Choline/ethanolamine kinase family protein	0.0221	0.0918	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Entamoeba histolytica	cysteine protease, putative	0.0081	0.0147	1
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0081	0.0147	0.1019
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Echinococcus multilocularis	small conductance calcium activated potassium	0.0346	0.1607	0.1482
Brugia malayi	Carboxylesterase family protein	0.0316	0.1442	0.1442
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Loa Loa (eye worm)	cysteine protease	0.0081	0.0147	0.0147
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Echinococcus granulosus	acetylcholinesterase	0.1873	1	1
Onchocerca volvulus		0.0081	0.0147	0.1019
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0081	0.0147	0.0147
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Trypanosoma cruzi	cysteine peptidase, putative	0.0081	0.0147	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0316	0.1442	0.1442
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Plasmodium falciparum	choline kinase	0.0221	0.0918	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Toxoplasma gondii	phosphotransferase enzyme family protein	0.0221	0.0918	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0316	0.1442	1
Echinococcus granulosus	neuroligin	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Schistosoma mansoni	gliotactin	0.0316	0.1442	0.1442
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Brugia malayi	Carboxylesterase family protein	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Schistosoma mansoni	cathepsin F (C01 family)	0.0081	0.0147	0.0147
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Echinococcus multilocularis	acetylcholinesterase	0.1873	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Schistosoma mansoni	BC026374 protein (S09 family)	0.0316	0.1442	0.1442
Loa Loa (eye worm)	carboxylesterase	0.0316	0.1442	0.1442
Brugia malayi	hypothetical protein	0.0316	0.1442	0.1442
Echinococcus granulosus	carboxylesterase 5A	0.1873	1	1
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Schistosoma mansoni	calcium-activated potassium channel	0.0274	0.1208	0.1208
Echinococcus granulosus	acetylcholinesterase	0.1873	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Onchocerca volvulus		0.0316	0.1442	1
Onchocerca volvulus		0.0081	0.0147	0.1019
Entamoeba histolytica	cysteine proteinase, putative	0.0081	0.0147	1
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0496	0.0496
Mycobacterium ulcerans	carboxylesterase, LipT	0.0316	0.1442	0.5
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0081	0.0147	0.0147
Trypanosoma cruzi	cruzipain precursor, putative	0.0081	0.0147	1
Loa Loa (eye worm)	hypothetical protein	0.0346	0.1607	0.1607
Brugia malayi	Papain family cysteine protease containing protein	0.0081	0.0147	0.0147
Echinococcus granulosus	small conductance calcium activated potassium	0.0346	0.1607	0.1607
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0081	0.0147	0.1019
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0147	0.0147
Trichomonas vaginalis	spcc417.12 protein, putative	0.0316	0.1442	1
Brugia malayi	Carboxylesterase family protein	0.0316	0.1442	0.1442
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0316	0.1442	0.5
Onchocerca volvulus		0.0316	0.1442	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Onchocerca volvulus		0.0081	0.0147	0.1019
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0316	0.1442	0.1442
Leishmania major	cysteine peptidase A (CPA)	0.0081	0.0147	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Schistosoma mansoni	hypothetical protein	0.0346	0.1607	0.1607
Plasmodium vivax	choline kinase, putative	0.0221	0.0918	1
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Loa Loa (eye worm)	hypothetical protein	0.1873	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Loa Loa (eye worm)	ctsf protein	0.0081	0.0147	0.0147
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Trypanosoma cruzi	cysteine peptidase, putative	0.0081	0.0147	1
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0316	0.1442	0.5
Loa Loa (eye worm)	hypothetical protein	0.013	0.0414	0.0414
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Loa Loa (eye worm)	choline/ethanolamine kinase	0.0221	0.0918	0.0918
Onchocerca volvulus		0.0316	0.1442	1
Echinococcus multilocularis	para nitrobenzyl esterase	0.0316	0.1442	0.1315
Echinococcus multilocularis	carboxylesterase 5A	0.1873	1	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.1873	1	1
Onchocerca volvulus	Cathepsin L homolog	0.0081	0.0147	0.1019
Loa Loa (eye worm)	carboxylesterase	0.1873	1	1
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0316	0.1442	0.1442
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Onchocerca volvulus		0.0316	0.1442	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0081	0.0147	0.0147
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0081	0.0147	0.1019
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Entamoeba histolytica	cysteine proteinase, putative	0.0081	0.0147	1
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Trypanosoma cruzi	cysteine peptidase, putative	0.0081	0.0147	1
Onchocerca volvulus	Cathepsin F homolog	0.0081	0.0147	0.1019
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0081	0.0147	0.5
Echinococcus multilocularis	choline:ethanolamine kinase	0.0221	0.0918	0.0782
Onchocerca volvulus		0.0081	0.0147	0.1019
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0081	0.0147	0.1019
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0316	0.1442	0.1442
Echinococcus granulosus	cathepsin l1	0.0081	0.0147	0.0147
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0081	0.0147	0.0147
Leishmania major	cathepsin L-like protease	0.0081	0.0147	0.5
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0316	0.1442	0.1442
Brugia malayi	Cathepsin L-like precursor	0.0081	0.0147	0.0147
Onchocerca volvulus	Cathepsin L homolog	0.0081	0.0147	0.1019
Onchocerca volvulus		0.0316	0.1442	1
Echinococcus multilocularis	neuroligin	0.0316	0.1442	0.1315

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 19 nM	Inhibition of human recombinant cathepsin S by fluorescence assay	ChEMBL.	18572405
IC50 (binding)	= 86 nM	Inhibition of human recombinant cathepsin L by fluorescence assay	ChEMBL.	18572405
IC50 (binding)	> 1000 nM	Inhibition of human recombinant cathepsin K by fluorescence assay	ChEMBL.	18572405

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: CHEMBL521700

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1017649