TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 728.822 | Formula: C39H52O13
H donors: 2 H acceptors: 8 LogP: 8.09 Rotable bonds: 31
Rule of 5 violations (Lipinski): 2
SMILES: O=C(O[C@@H](C(=O)OC(C(=O)O)C(=O)O)CC(=O)OCCC[C@H]([C@@H](Cc1ccccc1)C)OC(=O)C)CCCCCCCCCCOc1ccccc1
InChi: 1S/C39H52O13/c1-28(26-30-18-11-9-12-19-30)32(50-29(2)40)22-17-25-49-35(42)27-33(39(47)52-36(37(43)44)38(45)46)51-34(41)23-15-7-5-3-4-6-8-16-24-48-31-20-13-10-14-21-31/h9-14,18-21,28,32-33,36H,3-8,15-17,22-27H2,1-2H3,(H,43,44)(H,45,46)/t28-,32-,33-/m1/s1
InChiKey: FYAQTKSAFKYFLU-WDZQTAOZSA-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
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Echinococcus granulosus	cathepsin b	0.2762	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0333	0.1122	0.2069
Trypanosoma cruzi	cysteine peptidase, putative	0.1471	0.5281	0.5264
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Plasmodium falciparum	cysteine proteinase falcipain 3	0.1471	0.5281	1
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0333	0.1122	0.2069
Trypanosoma cruzi	cysteine peptidase, putative	0.0794	0.2808	0.2782
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0333	0.1122	0.2069
Onchocerca volvulus	Cathepsin L homolog	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Plasmodium vivax	vivapain-1	0.0794	0.2808	0.5307
Plasmodium vivax	vivapain-3	0.0794	0.2808	0.5307
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.1194	0.427	0.4263
Loa Loa (eye worm)	ctsf protein	0.1471	0.5281	0.5281
Loa Loa (eye worm)	hypothetical protein	0.1009	0.3595	0.3595
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0333	0.1122	0.2069
Echinococcus granulosus	calpain A	0.0056	0.0112	0.0104
Brugia malayi	fibroinase precursor	0.0333	0.1122	0.1122
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0333	0.1122	0.2106
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0036	0.0036	0.0492
Loa Loa (eye worm)	beta-lactamase	0.0036	0.0036	0.0036
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Entamoeba histolytica	cysteine proteinase, putative	0.1471	0.5281	1
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0333	0.1122	0.2106
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0794	0.2808	0.5284
Giardia lamblia	Cathepsin B precursor	0.0333	0.1122	0.2643
Entamoeba histolytica	cysteine proteinase, putative	0.0794	0.2808	0.5285
Schistosoma mansoni	cathepsin F (C01 family)	0.1471	0.5281	0.5275
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0036	0.0036	1
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Trichomonas vaginalis	conserved hypothetical protein	0.0333	0.1122	0.2069
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.1084	0.3868	0.7305
Echinococcus granulosus	cathepsin L cysteine proteinase	0.1471	0.5281	0.5277
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1009	0.3595	0.6785
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0333	0.1122	0.2069
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Schistosoma mansoni	hypothetical protein	0.0175	0.0546	0.0535
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.2762	1	1
Plasmodium vivax	hypothetical protein, conserved	0.0036	0.0036	0.0047
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0333	0.1122	0.1111
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.1471	0.5281	1
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0036	0.0025
Brugia malayi	Cathepsin L-like precursor	0.1009	0.3595	0.3595
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0461	0.1592	0.1592
Loa Loa (eye worm)	cathepsin B	0.1084	0.3868	0.3868
Giardia lamblia	Cathepsin B precursor	0.0333	0.1122	0.2643
Plasmodium vivax	unspecified product	0.0461	0.1592	0.2999
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0794	0.2808	0.2782
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0135	0.0135
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0202	0.0644	0.0644
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.1009	0.3595	0.3571
Trypanosoma cruzi	cysteine peptidase, putative	0.1471	0.5281	0.5264
Onchocerca volvulus		0.0034	0.0029	0.0032
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0012	0.0004
Plasmodium falciparum	serine repeat antigen 8	0.0333	0.1122	0.1917
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1009	0.3595	0.6785
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0333	0.1122	0.1111
Toxoplasma gondii	cathepsin CPC1	0.0333	0.1122	0.2106
Echinococcus multilocularis	prefoldin subunit 6	0.0063	0.0135	0.0123
Brugia malayi	Papain family cysteine protease containing protein	0.0794	0.2808	0.2808
Giardia lamblia	Hypothetical protein	0.0333	0.1122	0.2643
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1084	0.3868	0.3845
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Brugia malayi	Cathepsin L-like precursor	0.0461	0.1592	0.1592
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0012	0.0012
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Echinococcus multilocularis	cysteine protease	0.1471	0.5281	0.5275
Plasmodium falciparum	serine repeat antigen 1	0.0333	0.1122	0.1917
Brugia malayi	cathepsin F-like cysteine proteinase	0.0333	0.1122	0.1122
Trypanosoma cruzi	prefoldin subunit, putative	0.0063	0.0135	0.0099
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Onchocerca volvulus		0.003	0.0015	0.0007
Mycobacterium ulcerans	lipase LipD	0.0036	0.0036	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Entamoeba histolytica	cysteine proteinase, putative	0.1009	0.3595	0.6785
Onchocerca volvulus		0.0036	0.0036	0.0047
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Entamoeba histolytica	cysteine proteinase, putative	0.0794	0.2808	0.5285
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Brugia malayi	beta-lactamase family protein	0.0036	0.0036	0.0036
Echinococcus multilocularis	cathepsin b	0.2762	1	1
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Trypanosoma cruzi	cysteine protease, putative	0.0794	0.2808	0.2782
Brugia malayi	Papain family cysteine protease containing protein	0.0333	0.1122	0.1122
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0333	0.1122	0.2069
Toxoplasma gondii	prefoldin subunit 6, putative	0.0063	0.0135	0.0234
Mycobacterium tuberculosis	Probable hydrolase	0.0036	0.0036	0.0492
Brugia malayi	calpain family protein 1	0.0054	0.0103	0.0103
Onchocerca volvulus	Cathepsin L homolog	0.0333	0.1122	0.2106
Brugia malayi	Papain family cysteine protease containing protein	0.1471	0.5281	0.5281
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0333	0.1122	0.2069
Brugia malayi	cathepsin L-like precursor	0.1009	0.3595	0.3595
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0333	0.1122	0.1122
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Trypanosoma cruzi	cruzipain precursor, putative	0.0461	0.1592	0.1561
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Schistosoma mansoni	cathepsin s	0.0461	0.1592	0.1582
Plasmodium vivax	serine-repeat antigen (SERA)	0.0333	0.1122	0.2106
Brugia malayi	beta-lactamase family protein	0.0036	0.0036	0.0036
Trypanosoma cruzi	major cysteine proteinase, putative	0.0333	0.1122	0.1089
Brugia malayi	Cathepsin L-like precursor	0.1009	0.3595	0.3595
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2762	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1471	0.5281	0.5275
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0333	0.1122	0.2106
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0333	0.1122	0.2106
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0333	0.1122	0.2106
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Loa Loa (eye worm)	hypothetical protein	0.0461	0.1592	0.1592
Trypanosoma cruzi	major cysteine proteinase, putative	0.0333	0.1122	0.1089
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0036	0.0025
Echinococcus multilocularis	geminin	0.0175	0.0546	0.0535
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0054	0.0103	0.0091
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.1471	0.5281	1
Onchocerca volvulus		0.1471	0.5281	1
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0333	0.1122	0.2106
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Onchocerca volvulus		0.0333	0.1122	0.2106
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.0056	0.0112	0.01
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0794	0.2808	0.2782
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0461	0.1592	0.1592
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Brugia malayi	KE2 family protein	0.0063	0.0135	0.0135
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Schistosoma mansoni	cathepsin F (C01 family)	0.1009	0.3595	0.3587
Onchocerca volvulus		0.0036	0.0036	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Trichomonas vaginalis	conserved hypothetical protein	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0333	0.1122	0.2069
Plasmodium vivax	prefoldin subunit 6, putative	0.0063	0.0135	0.0234
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1471	0.5281	0.5281
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0333	0.1122	0.1917
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0333	0.1122	0.2069
Mycobacterium ulcerans	beta-lactamase	0.0036	0.0036	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0036	0.0492
Entamoeba histolytica	cysteine proteinase, putative	0.0794	0.2808	0.5285
Plasmodium falciparum	serine repeat antigen 5	0.0333	0.1122	0.1917
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.1471	0.5281	0.5281
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Plasmodium vivax	serine-repeat antigen (SERA)	0.0333	0.1122	0.2106
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Plasmodium falciparum	serine repeat antigen 4	0.0333	0.1122	0.1917
Plasmodium vivax	unspecified product	0.0333	0.1122	0.2106
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0333	0.1122	0.1111
Trypanosoma cruzi	cysteine peptidase, putative	0.1471	0.5281	0.5264
Plasmodium falciparum	serine repeat antigen 2	0.0333	0.1122	0.1917
Mycobacterium leprae	conserved hypothetical protein	0.0036	0.0036	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Toxoplasma gondii	cathepsin CPL	0.1471	0.5281	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0036	0.0036	0.0036
Trypanosoma brucei	prefoldin subunit, putative	0.0063	0.0135	0.0188
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Echinococcus granulosus	tachykinin peptides receptor 99D	0.1194	0.427	0.4265
Echinococcus granulosus	cathepsin b	0.2762	1	1
Plasmodium falciparum	serine repeat antigen 3	0.0333	0.1122	0.1917
Onchocerca volvulus	Matrilysin homolog	0.0047	0.0077	0.0124
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Plasmodium vivax	vivapain-2	0.1471	0.5281	1
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0036	0.0036	0.0025
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0333	0.1122	0.1111
Giardia lamblia	Hypothetical protein	0.0333	0.1122	0.2643
Entamoeba histolytica	cysteine proteinase, putative	0.1471	0.5281	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0051	0.0051
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Echinococcus granulosus	cathepsin L	0.0333	0.1122	0.1115
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0333	0.1122	0.1111
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0794	0.2808	0.5284
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Plasmodium falciparum	serine repeat antigen 7	0.0333	0.1122	0.1917
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0333	0.1122	0.2069
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2762	1	1
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0081	0.0081
Echinococcus multilocularis	cathepsin L cysteine protease	0.1471	0.5281	0.5275
Toxoplasma gondii	cathepsin CPC2	0.0333	0.1122	0.2106
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0333	0.1122	0.2106
Echinococcus granulosus	beta LACTamase domain containing family member	0.0036	0.0036	0.0029
Brugia malayi	Pre-SET motif family protein	0.0202	0.0644	0.0644
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0333	0.1122	0.1917
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0333	0.1122	0.1122
Echinococcus multilocularis	cathepsin L	0.0333	0.1122	0.1111
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0036	0.0036	0.0492
Echinococcus multilocularis	cathepsin b	0.2762	1	1
Trichomonas vaginalis	set domain proteins, putative	0.023	0.0746	0.1354
Echinococcus granulosus	cathepsin L	0.0794	0.2808	0.2802
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0333	0.1122	0.1111
Mycobacterium tuberculosis	Probable esterase LipL	0.0036	0.0036	0.0492
Echinococcus granulosus	geminin	0.0175	0.0546	0.0538
Echinococcus multilocularis	cysteine protease	0.1471	0.5281	0.5275
Giardia lamblia	Cathepsin L-like protease	0.0333	0.1122	0.2643
Loa Loa (eye worm)	hypothetical protein	0.1009	0.3595	0.3595
Echinococcus multilocularis	calpain family protein 1, d	0.004	0.0051	0.0039
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0036	0.0036	0.0492
Brugia malayi	beta-lactamase	0.0036	0.0036	0.0036
Loa Loa (eye worm)	hypothetical protein	0.2762	1	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0333	0.1122	0.1111
Mycobacterium ulcerans	esterase/lipase LipP	0.0036	0.0036	1
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0789	0.279	0.2782
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Schistosoma mansoni	cathepsin C	0.0333	0.1122	0.1111
Plasmodium falciparum	serine repeat antigen 9	0.0333	0.1122	0.1917
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0056	0.0112	0.01
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Loa Loa (eye worm)	calpain family protein 1	0.004	0.0051	0.0051
Schistosoma mansoni	hypothetical protein	0.0036	0.0036	0.0025
Entamoeba histolytica	cysteine proteinase, putative	0.0794	0.2808	0.5285
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0333	0.1122	0.2106
Onchocerca volvulus		0.1471	0.5281	1
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0333	0.1122	0.2106
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0333	0.1122	0.1111
Onchocerca volvulus		0.023	0.0746	0.1394
Toxoplasma gondii	cathepsin B	0.1084	0.3868	0.7318
Loa Loa (eye worm)	hypothetical protein	0.1471	0.5281	0.5281
Giardia lamblia	Cathepsin B precursor	0.0333	0.1122	0.2643
Loa Loa (eye worm)	matrixin family protein	0.0047	0.0077	0.0077
Echinococcus granulosus	cathepsin l cysteine peptidase	0.1471	0.5281	0.5277
Loa Loa (eye worm)	fibroinase	0.1471	0.5281	0.5281
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0333	0.1122	0.2069
Schistosoma mansoni	cathepsin F (C01 family)	0.1471	0.5281	0.5275
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.0077	0.0187	0.0179
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0228	0.074	1
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0333	0.1122	0.1122
Trypanosoma cruzi	cysteine peptidase, putative	0.0461	0.1592	0.1561
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2762	1	1
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0333	0.1122	0.1122
Entamoeba histolytica	hypothetical protein	0.0333	0.1122	0.2069
Brugia malayi	Matrixin family protein	0.0051	0.0093	0.0093
Onchocerca volvulus	Cathepsin F homolog	0.1471	0.5281	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0333	0.1122	0.1111
Giardia lamblia	Cathepsin B precursor	0.1084	0.3868	1
Brugia malayi	Papain family cysteine protease containing protein	0.0333	0.1122	0.1122
Echinococcus granulosus	cathepsin l1	0.1009	0.3595	0.359
Loa Loa (eye worm)	hypothetical protein	0.0333	0.1122	0.1122
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1471	0.5281	1
Entamoeba histolytica	cysteine protease, putative	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Onchocerca volvulus		0.1471	0.5281	1
Giardia lamblia	Cathepsin B precursor	0.1084	0.3868	1
Giardia lamblia	Cysteine protease	0.0333	0.1122	0.2643
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0036	0.0492
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0333	0.1122	0.2069
Echinococcus granulosus	cysteine protease	0.0794	0.2808	0.2802
Mycobacterium tuberculosis	Probable lipase LipD	0.0036	0.0036	0.0492
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0794	0.2808	0.5284
Leishmania major	cysteine peptidase A (CPA)	0.1471	0.5281	1
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0077	0.0187	0.0175
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0333	0.1122	0.2106
Plasmodium vivax	unspecified product	0.0794	0.2808	0.5307
Trichomonas vaginalis	conserved hypothetical protein	0.0063	0.0135	0.0188
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0461	0.1592	0.1592
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.1084	0.3868	0.7305
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0036	0.0028
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Plasmodium falciparum	serine repeat antigen 6	0.0333	0.1122	0.1917
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1084	0.3868	0.386
Entamoeba histolytica	cysteine proteinase 1, putative	0.0794	0.2808	0.5285
Brugia malayi	Papain family cysteine protease containing protein	0.0333	0.1122	0.1122
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Trypanosoma cruzi	cysteine peptidase, putative	0.1471	0.5281	0.5264
Schistosoma mansoni	hypothetical protein	0.0175	0.0546	0.0535
Onchocerca volvulus		0.1471	0.5281	1
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Onchocerca volvulus		0.1471	0.5281	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0029	0.0029
Echinococcus multilocularis	cathepsin L	0.0794	0.2808	0.2799
Entamoeba histolytica	cysteine proteinase 2	0.0794	0.2808	0.5285
Trypanosoma brucei	cysteine peptidase C (CPC)	0.1084	0.3868	0.7305
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0333	0.1122	0.2643
Loa Loa (eye worm)	cysteine protease	0.1471	0.5281	0.5281
Echinococcus multilocularis	cathepsin L cysteine protease	0.1471	0.5281	0.5275
Brugia malayi	calpain family protein 1	0.0054	0.0103	0.0103
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0794	0.2808	0.2802
Echinococcus multilocularis	calpain A	0.0056	0.0112	0.01
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Schistosoma mansoni	cathepsin S (C01 family)	0.0333	0.1122	0.1111
Giardia lamblia	Cathepsin B precursor	0.1084	0.3868	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0036	0.0036	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0103	0.0103
Trypanosoma cruzi	prefoldin subunit, putative	0.0063	0.0135	0.0099
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0794	0.2808	0.5284
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0047	0.0077	0.0124
Brugia malayi	cathepsin L precursor	0.0333	0.1122	0.1122
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.2762	1	1
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0036	0.0025
Giardia lamblia	Cysteine protease	0.0333	0.1122	0.2643
Giardia lamblia	Cathepsin B precursor	0.0333	0.1122	0.2643
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Loa Loa (eye worm)	matrixin family protein	0.0051	0.0093	0.0093
Entamoeba histolytica	cysteine protease, putative	0.1471	0.5281	1
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1471	0.5281	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1471	0.5281	0.5275
Onchocerca volvulus	Cathepsin L homolog	0.1471	0.5281	1
Brugia malayi	Pre-SET motif family protein	0.0029	0.0012	0.0012
Loa Loa (eye worm)	hypothetical protein	0.1009	0.3595	0.3595
Brugia malayi	Cathepsin L-like precursor	0.1471	0.5281	0.5281
Leishmania major	prefoldin subunit, putative	0.0063	0.0135	0.0188
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Toxoplasma gondii	ABC1 family protein	0.0036	0.0036	0.0047
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0333	0.1122	0.1122
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0333	0.1122	0.1122
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0036	0.0036
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0794	0.2808	0.2799
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Leishmania major	cathepsin L-like protease	0.1471	0.5281	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0333	0.1122	0.2643
Loa Loa (eye worm)	hypothetical protein	0.0461	0.1592	0.1592
Brugia malayi	Hemopexin family protein	0.003	0.0015	0.0015
Entamoeba histolytica	prefoldin subunit 6, putative	0.0063	0.0135	0.0188
Giardia lamblia	Encystation-specific protease	0.0333	0.1122	0.2643
Trypanosoma cruzi	cruzipain precursor, putative	0.1471	0.5281	0.5264
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0333	0.1122	0.2643
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Plasmodium vivax	vivapain-2	0.1471	0.5281	1
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0333	0.1122	0.1917
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0333	0.1122	0.2106
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0794	0.2808	0.5194
Loa Loa (eye worm)	hypothetical protein	0.0461	0.1592	0.1592
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0036	0.0025
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0036	0.0492
Mycobacterium leprae	Probable lipase LipE	0.0036	0.0036	1
Schistosoma mansoni	hypothetical protein	0.003	0.0015	0.0004
Brugia malayi	Papain family cysteine protease containing protein	0.0794	0.2808	0.2808
Mycobacterium ulcerans	hypothetical protein	0.0036	0.0036	1
Echinococcus granulosus	cathepsin l1	0.1471	0.5281	0.5277
Trypanosoma cruzi	cysteine proteinase, putative	0.0794	0.2808	0.2782
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Onchocerca volvulus		0.0036	0.0036	0.0047
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Mycobacterium tuberculosis	Probable lipase LipE	0.0036	0.0036	0.0492
Giardia lamblia	Cysteine protease	0.0333	0.1122	0.2643
Brugia malayi	cathepsin L-like cysteine proteinase	0.0333	0.1122	0.1122
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0333	0.1122	0.2069
Onchocerca volvulus		0.1009	0.3595	0.68
Brugia malayi	Cathepsin L-like cysteine proteinase	0.1009	0.3595	0.3595
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0794	0.2808	0.2799
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1471	0.5281	1
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Giardia lamblia	Cathepsin L-like protease	0.0333	0.1122	0.2643
Entamoeba histolytica	cysteine protease, putative	0.0794	0.2808	0.5285
Loa Loa (eye worm)	calpain family protein 1	0.0054	0.0103	0.0103
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0333	0.1122	0.2643
Brugia malayi	hypothetical protein	0.0036	0.0036	0.0036
Schistosoma mansoni	cathepsin B (C01 family)	0.0333	0.1122	0.1111
Echinococcus granulosus	prefoldin subunit 6	0.0063	0.0135	0.0127
Giardia lamblia	Cysteine protease	0.0333	0.1122	0.2643
Onchocerca volvulus		0.1471	0.5281	1
Schistosoma mansoni	hypothetical protein	0.0063	0.0135	0.0123
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0794	0.2808	0.2799
Giardia lamblia	Cathepsin L precursor	0.0333	0.1122	0.2643
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.0056	0.0112	0.0104
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0056	0.0112	0.01
Onchocerca volvulus		0.1471	0.5281	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1471	0.5281	1
Giardia lamblia	Cathepsin B precursor	0.0333	0.1122	0.2643

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (binding)	= 200 nM	Inhibitory activity against squalene synthase in rat liver squalene synthase (RLSS) enzyme assay	ChEMBL.	No reference
Activity (binding)	= 200 nM	Inhibitory activity against squalene synthase in rat liver squalene synthase (RLSS) enzyme assay	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

No literature references available for this target.

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Detailed information for compound 58246