TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 387.453 | Formula: C19H21N3O4S
H donors: 3 H acceptors: 5 LogP: 1.71 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc2c1ncnc2SCc1ccc(cc1)C
InChi: 1S/C19H21N3O4S/c1-11-2-4-12(5-3-11)9-27-18-13-6-7-22(17(13)20-10-21-18)19-16(25)15(24)14(8-23)26-19/h2-7,10,14-16,19,23-25H,8-9H2,1H3/t14-,15-,16-,19-/m1/s1
InChiKey: IJASPLNBAZAFJC-YKTARERQSA-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
Toxoplasma gondii	kinase, pfkB family protein	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Neospora caninum	GG10762, related	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma cruzi	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Schistosoma mansoni	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Schistosoma mansoni	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Leishmania major	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Leishmania braziliensis	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma brucei gambiense	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma congolense	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma brucei gambiense	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Onchocerca volvulus		Get druggable targets OG5_128398	All targets in OG5_128398
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128398	All targets in OG5_128398
Candida albicans	putative adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma brucei	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Leishmania infantum	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Trypanosoma brucei	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Cryptosporidium parvum	adenosine kinase like ribokinase	Get druggable targets OG5_128398	All targets in OG5_128398
Schistosoma japonicum	ko:K00856 adenosine kinase [EC2.7.1.20], putative	Get druggable targets OG5_128398	All targets in OG5_128398
Leishmania donovani	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Babesia bovis	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Leishmania mexicana	adenosine kinase, putative	Get druggable targets OG5_128398	All targets in OG5_128398
Toxoplasma gondii	kinase, pfkB family protein	Get druggable targets OG5_128398	All targets in OG5_128398
Echinococcus granulosus	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Candida albicans	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398
Brugia malayi	Adenosine kinase-like	Get druggable targets OG5_128398	All targets in OG5_128398
Echinococcus multilocularis	adenosine kinase	Get druggable targets OG5_128398	All targets in OG5_128398

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma brucei	calpain-like protein, putative	0.0206	0.2253	0.8713
Brugia malayi	Cathepsin L-like precursor	0.0139	0.0911	0.0689
Brugia malayi	calpain family protein 1	0.0547	0.9031	0.9007
Brugia malayi	calpain family protein 1	0.0547	0.9031	0.9007
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Loa Loa (eye worm)	hypothetical protein	0.0341	0.4926	0.4802
Onchocerca volvulus		0.0205	0.2225	0.4517
Echinococcus granulosus	cathepsin L	0.012	0.053	0.0299
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Loa Loa (eye worm)	hypothetical protein	0.0485	0.7797	0.7743
Loa Loa (eye worm)	calpain family protein 1	0.0547	0.9031	0.9007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0206	0.2253	0.2065
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.8713
Loa Loa (eye worm)	calpain 5	0.0144	0.1019	0.08
Trypanosoma cruzi	cysteine peptidase, putative	0.0205	0.2225	0.2036
Echinococcus granulosus	calpain 5	0.0206	0.2253	0.2065
Loa Loa (eye worm)	calpain	0.0206	0.2253	0.2065
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0139	0.0911	0.0689
Echinococcus granulosus	calpain A	0.0206	0.2253	0.2065
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0205	0.2225	0.2036
Echinococcus granulosus	cathepsin b	0.0596	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Plasmodium vivax	calpain, putative	0.0206	0.2253	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0221	0.2551	0.2369
Trypanosoma cruzi	cysteine peptidase, putative	0.0205	0.2225	0.2036
Trypanosoma brucei	antigen, putative	0.0206	0.2253	0.8713
Onchocerca volvulus	Cathepsin L homolog	0.0205	0.2225	0.4517
Echinococcus multilocularis	calpain A	0.059	0.9875	0.9872
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.8713
Echinococcus granulosus	cysteine protease	0.012	0.053	0.0299
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0205	0.2225	1
Trypanosoma brucei	calpain-like protein, putative	0.0206	0.2253	0.8713
Echinococcus multilocularis	hypothetical protein	0.0206	0.2253	0.2065
Toxoplasma gondii	cathepsin CPL	0.0205	0.2225	0.8591
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0911	0.0689
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Leishmania major	cysteine peptidase A (CPA)	0.0205	0.2225	0.8591
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Toxoplasma gondii	cathepsin B	0.0221	0.2551	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0596	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.012	0.053	0.0299
Echinococcus granulosus	cathepsin b	0.0596	1	1
Schistosoma mansoni	calpain C (C02 family)	0.0206	0.2253	0.2065
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trypanosoma cruzi	kinesin, putative	0.0144	0.1019	0.08
Brugia malayi	Papain family cysteine protease containing protein	0.0205	0.2225	0.2036
Schistosoma mansoni	calpain-7 (C02 family)	0.0206	0.2253	0.2065
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Giardia lamblia	Cathepsin B precursor	0.0221	0.2551	0.5
Onchocerca volvulus		0.0205	0.2225	0.4517
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.2065
Giardia lamblia	Cathepsin B precursor	0.0221	0.2551	0.5
Echinococcus multilocularis	cysteine protease	0.0205	0.2225	0.2036
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0205	0.2225	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0139	0.0911	0.1883
Trypanosoma cruzi	kinesin, putative	0.0144	0.1019	0.08
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0596	1	1
Onchocerca volvulus		0.0341	0.4926	1
Loa Loa (eye worm)	hypothetical protein	0.0596	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Echinococcus multilocularis	cathepsin L cysteine protease	0.0205	0.2225	0.2036
Schistosoma mansoni	cathepsin F (C01 family)	0.0205	0.2225	0.2036
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.012	0.053	0.1263
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.8713
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.012	0.053	0.1263
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0911	0.0689
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Onchocerca volvulus		0.0205	0.2225	0.4517
Onchocerca volvulus	Cathepsin F homolog	0.0205	0.2225	0.4517
Trypanosoma cruzi	cysteine proteinase, putative	0.012	0.053	0.0299
Brugia malayi	Papain family cysteine protease containing protein	0.012	0.053	0.0299
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Trypanosoma cruzi	cruzipain precursor, putative	0.0205	0.2225	0.2036
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0139	0.0911	0.1883
Echinococcus multilocularis	calpain family protein 1, d	0.0403	0.616	0.6066
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.0589	0.9852	0.9848
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.0589	0.9852	0.9848
Echinococcus granulosus	calpain 7 C02 family	0.0206	0.2253	0.2065
Loa Loa (eye worm)	ctsf protein	0.0205	0.2225	0.2036
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Plasmodium vivax	vivapain-2	0.0205	0.2225	0.9836
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0221	0.2551	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Echinococcus multilocularis	cathepsin L	0.012	0.053	0.0299
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Trypanosoma cruzi	cysteine peptidase, putative	0.012	0.053	0.0299
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0589	0.9852	0.9848
Trypanosoma cruzi	cysteine proteinase, putative	0.012	0.053	0.0299
Trypanosoma cruzi	cysteine protease, putative	0.012	0.053	0.0299
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.012	0.053	0.0299
Entamoeba histolytica	protein kinase, putative	0.0144	0.1019	0.2886
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Echinococcus multilocularis	calpain 7 (C02 family)	0.0206	0.2253	0.2065
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Schistosoma mansoni	cathepsin F (C01 family)	0.0139	0.0911	0.0689
Schistosoma mansoni	calpain (C02 family)	0.0206	0.2253	0.2065
Loa Loa (eye worm)	cysteine protease	0.0205	0.2225	0.2036
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Brugia malayi	cathepsin L-like precursor	0.0139	0.0911	0.0689
Entamoeba histolytica	cysteine proteinase, putative	0.0139	0.0911	0.2244
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0205	0.2225	0.2036
Trypanosoma cruzi	cysteine peptidase, putative	0.0205	0.2225	0.2036
Onchocerca volvulus		0.0205	0.2225	0.4517
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.2065
Leishmania major	kinesin, putative	0.0144	0.1019	0.3378
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0205	0.2225	0.2036
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.012	0.053	0.0299
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0547	0.9031	0.9007
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Trypanosoma brucei	calpain-like protein, putative	0.0206	0.2253	0.8713
Trypanosoma cruzi	cysteine peptidase, putative	0.0205	0.2225	0.2036
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Onchocerca volvulus		0.0205	0.2225	0.4517
Echinococcus multilocularis	cathepsin L cysteine protease	0.0205	0.2225	0.2036
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.2065
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0139	0.0911	0.0689
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Brugia malayi	Cathepsin L-like precursor	0.0139	0.0911	0.0689
Onchocerca volvulus		0.0205	0.2225	0.4517
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0205	0.2225	0.2036
Giardia lamblia	Cathepsin B precursor	0.0221	0.2551	0.5
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.2065
Loa Loa (eye worm)	fibroinase	0.0205	0.2225	0.2036
Echinococcus multilocularis	cysteine protease	0.0205	0.2225	0.2036
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Echinococcus granulosus	calpain	0.0206	0.2253	0.2065
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0596	1	1
Entamoeba histolytica	cysteine protease, putative	0.0205	0.2225	1
Loa Loa (eye worm)	cathepsin B	0.0221	0.2551	0.2369
Onchocerca volvulus	Cathepsin L homolog	0.0205	0.2225	0.4517
Echinococcus granulosus	cathepsin l1	0.0205	0.2225	0.2036
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Leishmania major	calpain, putative,cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.8713
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.2065
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0205	0.2225	0.8387
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.012	0.053	0.0299
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0221	0.2551	0.2369
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Trypanosoma brucei	calpain-like protein, putative	0.0206	0.2253	0.8713
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0205	0.2225	0.2036
Brugia malayi	Cathepsin L-like precursor	0.0205	0.2225	0.2036
Onchocerca volvulus		0.0205	0.2225	0.4517
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0589	0.9852	0.9848
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Echinococcus multilocularis	cathepsin b	0.0596	1	1
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0205	0.2225	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.2065
Brugia malayi	Papain family cysteine protease containing protein	0.012	0.053	0.0299
Brugia malayi	calpain 5	0.0144	0.1019	0.08
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0911	0.0689
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.8713
Echinococcus multilocularis	cathepsin b	0.0596	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Entamoeba histolytica	cysteine proteinase, putative	0.0205	0.2225	1
Plasmodium vivax	vivapain-2	0.0205	0.2225	0.9836
Loa Loa (eye worm)	hypothetical protein	0.0547	0.9031	0.9007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0221	0.2551	1
Loa Loa (eye worm)	hypothetical protein	0.0205	0.2225	0.2036
Entamoeba histolytica	cysteine proteinase, putative	0.0205	0.2225	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0205	0.2225	0.8591
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.2065
Loa Loa (eye worm)	hypothetical protein	0.0403	0.616	0.6066
Echinococcus granulosus	cathepsin l1	0.0139	0.0911	0.0689
Trypanosoma brucei	kinesin, putative	0.0144	0.1019	0.3378
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Echinococcus multilocularis	calpain	0.0206	0.2253	0.2065
Schistosoma mansoni	cathepsin F (C01 family)	0.0205	0.2225	0.2036
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0206	0.2253	0.2065
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0206	0.2253	0.2065
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0221	0.2551	1
Loa Loa (eye worm)	calpain family protein 1	0.0403	0.616	0.6066
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Schistosoma mansoni	Mername-AA248 (C02 family)	0.0206	0.2253	0.2065
Echinococcus granulosus	cathepsin L cysteine protease	0.012	0.053	0.0299
Leishmania major	cathepsin L-like protease	0.0205	0.2225	0.8591
Brugia malayi	calpain 7	0.0206	0.2253	0.2065
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0205	0.2225	0.2036
Schistosoma mansoni	calpain-7 (C02 family)	0.0206	0.2253	0.2065
Entamoeba histolytica	calpain large subunit domain III containing protein	0.0144	0.1019	0.2886
Echinococcus granulosus	calpain A	0.059	0.9875	0.9872
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0596	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0596	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0205	0.2225	0.8387
Echinococcus multilocularis	calpain 5	0.0206	0.2253	0.2065
Onchocerca volvulus		0.0139	0.0911	0.1849

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 19 uM	Binding affinity to purified Toxoplasma gondii adenosine kinase	ChEMBL.	18563892

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: CHEMBL479812

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 977618