TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 314.725 | Formula: C12H15ClN4O4
H donors: 4 H acceptors: 5 LogP: -0.53 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: OC[C@@H]1O[C@H]([C@@]([C@@H]1O)(C)O)n1cc(c2c1ncnc2N)Cl
InChi: 1S/C12H15ClN4O4/c1-12(20)8(19)6(3-18)21-11(12)17-2-5(13)7-9(14)15-4-16-10(7)17/h2,4,6,8,11,18-20H,3H2,1H3,(H2,14,15,16)/t6-,8-,11?,12-/m1/s1
InChiKey: YHGONMJQXOIGJS-JZIHMUKYSA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	calpain 5	0.0473	0.2506	0.2506
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0082	0.0022	0.0073
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0082	0.0022	0.0073
Trypanosoma brucei	cysteine peptidase, putative	0.0125	0.0291	0.0965
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Brugia malayi	calpain 5	0.0348	0.1712	0.1712
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Entamoeba histolytica	cysteine protease, putative	0.0114	0.0222	0.1295
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1649	1	1
Entamoeba histolytica	hypothetical protein, conserved	0.008	0.0009	0.0051
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0082	0.0022	0.0022
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0114	0.0222	0.7626
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Plasmodium vivax	vivapain-1	0.0082	0.0022	0.0087
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0125	0.0291	0.0291
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Schistosoma mansoni	cathepsin F (C01 family)	0.0114	0.0222	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Brugia malayi	cathepsin L-like precursor	0.0092	0.0085	0.0085
Trichomonas vaginalis	calcium binding protein, putative	0.009	0.0069	0.0229
Echinococcus multilocularis	cathepsin b	0.1649	1	1
Echinococcus multilocularis	hypothetical protein	0.0473	0.2506	0.2506
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.2506
Entamoeba histolytica	cysteine proteinase, putative	0.0114	0.0222	0.1295
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0082	0.0022	0.0073
Brugia malayi	Papain family cysteine protease containing protein	0.0082	0.0022	0.0022
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Loa Loa (eye worm)	hypothetical protein	0.0946	0.552	0.552
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.2506
Schistosoma mansoni	calpain-2 (C02 family)	0.0125	0.0291	0.0291
Echinococcus multilocularis	calpain family protein 1, d	0.0946	0.552	0.552
Echinococcus multilocularis	cysteine protease	0.0114	0.0222	0.0222
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0082	0.0022	0.0022
Entamoeba histolytica	protein kinase, putative	0.0348	0.1712	1
Onchocerca volvulus		0.0114	0.0222	0.0469
Leishmania major	calpain, putative,cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.8315
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 33	0.008	0.0009	0.0009
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trypanosoma brucei	calpain, putative	0.0125	0.0291	0.0965
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Onchocerca volvulus	Cathepsin L homolog	0.0114	0.0222	0.0469
Echinococcus multilocularis	calpain 7 (C02 family)	0.0473	0.2506	0.2506
Loa Loa (eye worm)	hypothetical protein	0.1294	0.7736	0.7736
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Plasmodium vivax	vivapain-2	0.0114	0.0222	0.0885
Plasmodium vivax	calpain, putative	0.0473	0.2506	1
Trichomonas vaginalis	calpain, putative	0.0125	0.0291	0.0965
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0114	0.0222	0.0222
Leishmania major	hypothetical protein, unknown function	0.0125	0.0291	0.0965
Trypanosoma cruzi	centrin, putative	0.009	0.0069	0.0069
Echinococcus multilocularis	calumenin	0.008	0.0009	0.0009
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.2506
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0085	0.0085
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Entamoeba histolytica	cysteine proteinase, putative	0.0082	0.0022	0.0128
Schistosoma mansoni	hypothetical protein	0.0125	0.0291	0.0291
Echinococcus multilocularis	calpain	0.0473	0.2506	0.2506
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Trypanosoma brucei	Calpain-like protein 2	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0552	0.3014	0.3014
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0085	0.0085
Trypanosoma brucei	cytoskeleton-associated protein CAP5.5, putative	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.2506
Echinococcus granulosus	cathepsin L cysteine protease	0.0082	0.0022	0.0022
Trypanosoma brucei	calpain, putative	0.0125	0.0291	0.0965
Plasmodium vivax	vivapain-3	0.0082	0.0022	0.0087
Trypanosoma brucei	hypothetical protein	0.0125	0.0291	0.0965
Trypanosoma brucei	calpain-like protein, putative	0.0473	0.2506	0.8315
Brugia malayi	calpain 5	0.0125	0.0291	0.0291
Echinococcus multilocularis	cathepsin L cysteine protease	0.0114	0.0222	0.0222
Loa Loa (eye worm)	calpain D	0.0125	0.0291	0.0291
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0114	0.0222	0.0736
Brugia malayi	Cathepsin L-like precursor	0.0092	0.0085	0.0085
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Onchocerca volvulus		0.0821	0.4726	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1649	1	1
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0125	0.0291	0.0291
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Loa Loa (eye worm)	programmed cell death protein 6	0.008	0.0009	0.0009
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.8315
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0552	0.3014	1
Echinococcus multilocularis	calbindin 32	0.008	0.0009	0.0009
Echinococcus granulosus	cathepsin L	0.0082	0.0022	0.0022
Trypanosoma brucei	glucosamine 6-phosphate n-acetyltransferase	0.0125	0.0291	0.0965
Trichomonas vaginalis	calcineurin B subunit, putative	0.008	0.0009	0.0029
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0965
Giardia lamblia	Cathepsin B precursor	0.0552	0.3014	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Schistosoma mansoni	Mername-AA248 (C02 family)	0.0473	0.2506	0.2506
Onchocerca volvulus	Cathepsin L homolog	0.0114	0.0222	0.0469
Plasmodium vivax	hypothetical protein, conserved	0.008	0.0009	0.0035
Onchocerca volvulus		0.0114	0.0222	0.0469
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0114	0.0222	0.0222
Leishmania major	calpain-like protein, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1373	0.8239	0.8239
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0114	0.0222	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma cruzi	kinesin, putative	0.0348	0.1712	0.1712
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.1373	0.8239	0.8239
Trichomonas vaginalis	conserved hypothetical protein	0.0125	0.0291	0.0965
Echinococcus granulosus	calpain 5	0.0473	0.2506	0.2506
Onchocerca volvulus	Cathepsin F homolog	0.0114	0.0222	0.0469
Toxoplasma gondii	cathepsin CPL	0.0114	0.0222	0.0736
Loa Loa (eye worm)	calpain family protein 1	0.0946	0.552	0.552
Trypanosoma cruzi	cysteine peptidase, putative	0.0082	0.0022	0.0022
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0114	0.0222	0.0736
Echinococcus granulosus	calpain A	0.0473	0.2506	0.2506
Brugia malayi	EF hand family protein	0.008	0.0009	0.0009
Leishmania major	hypothetical protein, conserved	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.2506
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0092	0.0085	0.0085
Echinococcus multilocularis	cathepsin L cysteine protease	0.0114	0.0222	0.0222
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Schistosoma mansoni	calpain C (C02 family)	0.0473	0.2506	0.2506
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.2506
Entamoeba histolytica	cysteine proteinase, putative	0.0114	0.0222	0.1295
Onchocerca volvulus		0.0114	0.0222	0.0469
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Loa Loa (eye worm)	cysteine protease	0.0114	0.0222	0.0222
Entamoeba histolytica	cysteine proteinase, putative	0.0082	0.0022	0.0128
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Brugia malayi	calpain family protein 1	0.1294	0.7736	0.7736
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1294	0.7736	0.7736
Schistosoma mansoni	cathepsin F (C01 family)	0.0114	0.0222	0.0222
Echinococcus granulosus	EF hand domain containing family member A2	0.008	0.0009	0.0009
Schistosoma mansoni	calpain-7 (C02 family)	0.0473	0.2506	0.2506
Trichomonas vaginalis	hypothetical protein	0.0125	0.0291	0.0965
Trypanosoma brucei	caltractin, putative	0.009	0.0069	0.0229
Echinococcus granulosus	calumenin	0.008	0.0009	0.0009
Schistosoma mansoni	reticulocalbin	0.008	0.0009	0.0009
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma cruzi	cysteine proteinase, putative	0.0082	0.0022	0.0022
Toxoplasma gondii	calcium-dependent protein kinase	0.008	0.0009	0.0029
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma cruzi	kinesin, putative	0.0348	0.1712	0.1712
Entamoeba histolytica	cysteine proteinase 2	0.0082	0.0022	0.0128
Onchocerca volvulus		0.0114	0.0222	0.0469
Loa Loa (eye worm)	hypothetical protein	0.0114	0.0222	0.0222
Echinococcus granulosus	calpain 7 C02 family	0.0473	0.2506	0.2506
Leishmania major	calpain family cysteine protease-like protein	0.0125	0.0291	0.0965
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Echinococcus granulosus	calbindin 32	0.008	0.0009	0.0009
Schistosoma mansoni	calpain-7 (C02 family)	0.0473	0.2506	0.2506
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine peptidase, putative	0.0114	0.0222	0.0222
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Entamoeba histolytica	grainin, putative	0.008	0.0009	0.0051
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0552	0.3014	1
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0125	0.0291	0.0291
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0092	0.0085	0.0085
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Leishmania major	kinesin, putative	0.0348	0.1712	0.5681
Plasmodium falciparum	calpain	0.0125	0.0291	1
Brugia malayi	calpain family protein 1	0.1294	0.7736	0.7736
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0114	0.0222	0.0222
Trypanosoma brucei	calpain-like protein, putative	0.0473	0.2506	0.8315
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Loa Loa (eye worm)	hypothetical protein	0.0125	0.0291	0.0291
Trypanosoma cruzi	centrin-3	0.009	0.0069	0.0069
Trypanosoma brucei	calpain-like protein, putative	0.0473	0.2506	0.8315
Echinococcus multilocularis	cathepsin b	0.1649	1	1
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0125	0.0291	0.0291
Trypanosoma cruzi	cysteine peptidase, putative	0.0114	0.0222	0.0222
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.1373	0.8239	0.8239
Brugia malayi	Papain family cysteine protease containing protein	0.0114	0.0222	0.0222
Echinococcus granulosus	cathepsin b	0.1649	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0082	0.0022	0.0022
Trichomonas vaginalis	calpain, putative	0.0125	0.0291	0.0965
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.8315
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Echinococcus multilocularis	programmed cell death protein	0.009	0.0069	0.0069
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Echinococcus multilocularis	calpain A	0.1374	0.8248	0.8248
Echinococcus multilocularis	cathepsin L	0.0082	0.0022	0.0022
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.2506
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Giardia lamblia	Cathepsin B precursor	0.0552	0.3014	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Loa Loa (eye worm)	calpain	0.0473	0.2506	0.2506
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0473	0.2506	0.8315
Onchocerca volvulus		0.0114	0.0222	0.0469
Entamoeba histolytica	cysteine proteinase 1, putative	0.0082	0.0022	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0085	0.0085
Leishmania major	cysteine peptidase A (CPA)	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Brugia malayi	calpain D	0.0125	0.0291	0.0291
Leishmania major	cytoskeleton-associated protein CAP5.5, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Schistosoma mansoni	calcium binding atopy-related autoantigen	0.008	0.0009	0.0009
Plasmodium vivax	unspecified product	0.0082	0.0022	0.0087
Echinococcus granulosus	programmed cell death protein	0.009	0.0069	0.0069
Entamoeba histolytica	calpain family cysteine protease, putative	0.0125	0.0291	0.1698
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma brucei	Calpain-like protein 1.2	0.0125	0.0291	0.0965
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Toxoplasma gondii	calpain family cysteine protease domain-containing protein	0.0125	0.0291	0.0965
Entamoeba histolytica	cysteine proteinase, putative	0.0082	0.0022	0.0128
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Echinococcus granulosus	cathepsin l1	0.0092	0.0085	0.0085
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Brugia malayi	calpain 7	0.0473	0.2506	0.2506
Trypanosoma brucei	calpain-like protein, putative	0.0473	0.2506	0.8315
Loa Loa (eye worm)	cathepsin B	0.0552	0.3014	0.3014
Echinococcus multilocularis	cysteine protease	0.0114	0.0222	0.0222
Trypanosoma brucei	calmodulin, putative	0.008	0.0009	0.0029
Trichomonas vaginalis	calmodulin, putative	0.008	0.0009	0.0029
Loa Loa (eye worm)	ctsf protein	0.0114	0.0222	0.0222
Trypanosoma cruzi	cysteine peptidase, putative	0.0114	0.0222	0.0222
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1649	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0082	0.0022	0.0128
Toxoplasma gondii	cathepsin B	0.0552	0.3014	1
Leishmania major	calpain protease-like protein	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine protease, putative	0.0082	0.0022	0.0022
Toxoplasma gondii	hypothetical protein	0.0125	0.0291	0.0965
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.8315
Echinococcus multilocularis	EF hand domain containing family member A2	0.008	0.0009	0.0009
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0082	0.0022	0.0073
Trypanosoma brucei	kinesin, putative	0.0348	0.1712	0.5681
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0114	0.0222	0.0222
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1649	1	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma brucei	Calpain-like protein CALP1.3	0.0125	0.0291	0.0965
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0092	0.0085	0.0284
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0092	0.0085	0.0284
Entamoeba histolytica	grainin 2	0.009	0.0069	0.0404
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Echinococcus multilocularis	programmed cell death protein	0.009	0.0069	0.0069
Onchocerca volvulus		0.0092	0.0085	0.0181
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Plasmodium vivax	vivapain-2	0.0114	0.0222	0.0885
Trypanosoma cruzi	cruzipain precursor, putative	0.0114	0.0222	0.0222
Leishmania major	cathepsin L-like protease	0.0114	0.0222	0.0736
Giardia lamblia	Cathepsin B precursor	0.0552	0.3014	1
Toxoplasma gondii	calmodulin CAM1	0.008	0.0009	0.0029
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1373	0.8239	0.8239
Trypanosoma cruzi	conserved protein	0.0125	0.0291	0.0291
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0125	0.0291	0.0291
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0114	0.0222	0.0222
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0291
Echinococcus granulosus	calcium uptake protein 1	0.008	0.0009	0.0009
Loa Loa (eye worm)	calpain 5	0.0348	0.1712	0.1712
Entamoeba histolytica	calpain large subunit domain III containing protein	0.0348	0.1712	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0114	0.0222	0.0736
Trypanosoma cruzi	cysteine peptidase, putative	0.0114	0.0222	0.0222
Schistosoma mansoni	cathepsin F (C01 family)	0.0092	0.0085	0.0085
Loa Loa (eye worm)	fibroinase	0.0114	0.0222	0.0222
Onchocerca volvulus		0.008	0.0009	0.0019
Loa Loa (eye worm)	hypothetical protein	0.1649	1	1
Trichomonas vaginalis	calpain, putative	0.0125	0.0291	0.0965
Trypanosoma brucei	Calpain-like protein 1.1	0.0125	0.0291	0.0965
Leishmania major	hypothetical protein, conserved	0.008	0.0009	0.0029
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.2506
Trypanosoma cruzi	cysteine proteinase, putative	0.0082	0.0022	0.0022
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Loa Loa (eye worm)	calpain family protein 1	0.1294	0.7736	0.7736
Echinococcus granulosus	calpain	0.0473	0.2506	0.2506
Trichomonas vaginalis	Clan CA, family C2, calpain-like cysteine peptidase	0.0125	0.0291	0.0965
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0114	0.0222	0.7626
Trypanosoma brucei	centrin-3	0.009	0.0069	0.0229
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0114	0.0222	0.0736
Echinococcus granulosus	cysteine protease	0.0082	0.0022	0.0022
Loa Loa (eye worm)	hypothetical protein	0.1169	0.6942	0.6942
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0125	0.0291	0.0965
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0082	0.0022	0.0022
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0473	0.2506	0.2506
Loa Loa (eye worm)	hypothetical protein	0.0821	0.4726	0.4726
Trypanosoma cruzi	centrin, putative	0.009	0.0069	0.0069
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1649	1	1
Onchocerca volvulus		0.0114	0.0222	0.0469
Brugia malayi	Cathepsin L-like precursor	0.0114	0.0222	0.0222
Echinococcus granulosus	cathepsin l1	0.0114	0.0222	0.0222
Echinococcus granulosus	cathepsin b	0.1649	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0082	0.0022	0.0022
Entamoeba histolytica	cysteine proteinase, putative	0.0092	0.0085	0.0499
Brugia malayi	Cathepsin L-like precursor	0.0092	0.0085	0.0085
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0552	0.3014	1
Echinococcus multilocularis	calcium uptake protein 1	0.008	0.0009	0.0009
Trichomonas vaginalis	calmodulin, putative	0.009	0.0069	0.0229
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Trypanosoma brucei	antigen, putative	0.0473	0.2506	0.8315
Onchocerca volvulus		0.0114	0.0222	0.0469
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Entamoeba histolytica	cysteine protease, putative	0.0082	0.0022	0.0128
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0114	0.0222	0.7626
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0473	0.2506	0.2506
Echinococcus granulosus	calpain A	0.1374	0.8248	0.8248
Schistosoma mansoni	calpain (C02 family)	0.0473	0.2506	0.2506
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0082	0.0022	0.0754
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0552	0.3014	0.3014

Activities

Activity type	Activity value	Assay description	Source	Reference
CC50 (functional)	~ 50 uM	Cytotoxicity of the compound against HB-1 cells in an MTS-based assay	ChEMBL.	15456273
EC50 (functional)	= 0.13 uM	Inhibition of HCV RNA replication in a subgenomic bicistronic replicon assay in HB-1 cells	ChEMBL.	15456273

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: 413612

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 328925