TDR Targets

Basic information

Technical information

TDR Targets ID: 220871
Name: N-[4-[[1-[(2-fluorophenyl)methyl]-3-(4-hydrox ybutyl)-2,6-dioxo-7H-purin-8-yl]methyl]phenyl ]acetamide
MW: 479.503 | Formula: C25H26FN5O4
H donors: 3 H acceptors: 5 LogP: 2.37 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: OCCCCn1c2[nH]c(nc2c(=O)n(c1=O)Cc1ccccc1F)Cc1ccc(cc1)NC(=O)C
InChi: 1S/C25H26FN5O4/c1-16(33)27-19-10-8-17(9-11-19)14-21-28-22-23(29-21)30(12-4-5-13-32)25(35)31(24(22)34)15-18-6-2-3-7-20(18)26/h2-3,6-11,32H,4-5,12-15H2,1H3,(H,27,33)(H,28,29)
InChiKey: UAOGMHJQDHLDCC-UHFFFAOYSA-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

N-[4-[[1-[(2-fluorophenyl)methyl]-3-(4-hydroxybutyl)-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]ethanamide
N-[4-[[1-(2-fluorobenzyl)-3-(4-hydroxybutyl)-2,6-diketo-7H-purin-8-yl]methyl]phenyl]acetamide

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
Loa Loa (eye worm)	hypothetical protein	0.049	0.3612	0.3612
Toxoplasma gondii	cathepsin CPL	0.0715	0.5394	1
Schistosoma mansoni	cathepsin B (C01 family)	0.0161	0.0999	0.0999
Echinococcus granulosus	cathepsin l1	0.0715	0.5394	0.5394
Chlamydia trachomatis	pyruvate kinase	0.0035	0	0.5
Brugia malayi	Papain family cysteine protease containing protein	0.0161	0.0999	0.0999
Brugia malayi	cathepsin F-like cysteine proteinase	0.0161	0.0999	0.0999
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Onchocerca volvulus		0.0715	0.5394	1
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Echinococcus multilocularis	cathepsin b	0.1296	1	1
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0161	0.0999	0.0999
Trypanosoma cruzi	cysteine peptidase, putative	0.0715	0.5394	0.5394
Echinococcus granulosus	tar DNA binding protein	0.0062	0.0214	0.0214
Entamoeba histolytica	cysteine proteinase, putative	0.0385	0.2781	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Plasmodium falciparum	serine repeat antigen 6	0.0161	0.0999	0.1852
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0715	0.5394	1
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine proteinase, putative	0.0385	0.2781	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0715	0.5394	0.5394
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Brugia malayi	Papain family cysteine protease containing protein	0.0161	0.0999	0.0999
Brugia malayi	hypothetical protein	0.0229	0.1541	0.1541
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Brugia malayi	Papain family cysteine protease containing protein	0.0385	0.2781	0.2781
Giardia lamblia	Cathepsin L-like protease	0.0161	0.0999	0.2641
Brugia malayi	cathepsin L-like cysteine proteinase	0.0161	0.0999	0.0999
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Plasmodium vivax	vivapain-1	0.0385	0.2781	0.5155
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0161	0.0999	0.0999
Schistosoma mansoni	cathepsin F (C01 family)	0.0715	0.5394	0.5394
Trypanosoma cruzi	cysteine peptidase, putative	0.0225	0.1508	0.1508
Trypanosoma cruzi	cysteine peptidase, putative	0.0715	0.5394	0.5394
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0385	0.2781	0.5155
Onchocerca volvulus		0.0715	0.5394	1
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Giardia lamblia	Cathepsin B precursor	0.0161	0.0999	0.2641
Entamoeba histolytica	cysteine proteinase, putative	0.0715	0.5394	1
Echinococcus multilocularis	cysteine protease	0.0715	0.5394	0.5394
Echinococcus granulosus	cathepsin b	0.1296	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.0385	0.2781	0.2781
Schistosoma mansoni	cathepsin S (C01 family)	0.0161	0.0999	0.0999
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Plasmodium falciparum	serine repeat antigen 5	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine proteinase 2	0.0385	0.2781	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0161	0.0999	0.0999
Loa Loa (eye worm)	hypothetical protein	0.0225	0.1508	0.1508
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Echinococcus granulosus	cathepsin b	0.1296	1	1
Plasmodium vivax	unspecified product	0.0385	0.2781	0.5155
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Giardia lamblia	Cathepsin B precursor	0.0161	0.0999	0.2641
Trichomonas vaginalis	conserved hypothetical protein	0.0161	0.0999	0.1852
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0715	0.5394	0.5394
Brugia malayi	fibroinase precursor	0.0161	0.0999	0.0999
Brugia malayi	Cathepsin L-like cysteine proteinase	0.049	0.3612	0.3612
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0512	0.3783	0.7013
Brugia malayi	cathepsin L precursor	0.0161	0.0999	0.0999
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0385	0.2781	0.2781
Brugia malayi	RNA recognition motif domain containing protein	0.0062	0.0214	0.0214
Echinococcus granulosus	cathepsin L	0.0385	0.2781	0.2781
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.0999	0.0999
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Onchocerca volvulus	Cathepsin L homolog	0.0715	0.5394	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	0.0214	0.0214
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0161	0.0999	0.1852
Giardia lamblia	Cathepsin B precursor	0.0161	0.0999	0.2641
Loa Loa (eye worm)	hypothetical protein	0.0225	0.1508	0.1508
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0161	0.0999	0.0999
Plasmodium vivax	unspecified product	0.0225	0.1508	0.2796
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0512	0.3783	0.3783
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Echinococcus multilocularis	survival motor neuron protein 1	0.0229	0.1541	0.1541
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0214	0.0214
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0512	0.3783	0.3783
Trypanosoma cruzi	cruzipain precursor, putative	0.0225	0.1508	0.1508
Echinococcus granulosus	cathepsin L cysteine protease	0.0385	0.2781	0.2781
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine proteinase 1, putative	0.0385	0.2781	0.4054
Giardia lamblia	Cathepsin B precursor	0.0161	0.0999	0.2641
Plasmodium falciparum	serine repeat antigen 4	0.0161	0.0999	0.1852
Brugia malayi	Papain family cysteine protease containing protein	0.0161	0.0999	0.0999
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1296	1	1
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Trypanosoma cruzi	major cysteine proteinase, putative	0.0161	0.0999	0.0999
Giardia lamblia	Cathepsin B precursor	0.0512	0.3783	1
Echinococcus multilocularis	cysteine protease	0.0715	0.5394	0.5394
Plasmodium falciparum	serine repeat antigen 2	0.0161	0.0999	0.1852
Mycobacterium ulcerans	pyruvate kinase	0.0035	0	0.5
Onchocerca volvulus		0.049	0.3612	0.6697
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0512	0.3783	0.7013
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0385	0.2781	0.5155
Plasmodium vivax	vivapain-2	0.0715	0.5394	1
Plasmodium falciparum	serine repeat antigen 8	0.0161	0.0999	0.1852
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Echinococcus multilocularis	cathepsin L	0.0161	0.0999	0.0999
Toxoplasma gondii	cathepsin CPC1	0.0161	0.0999	0.1852
Onchocerca volvulus	Cathepsin L homolog	0.0161	0.0999	0.1852
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0161	0.0999	0.2641
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0715	0.5394	1
Loa Loa (eye worm)	cathepsin B	0.0512	0.3783	0.3783
Mycobacterium tuberculosis	Probable pyruvate kinase PykA	0.0035	0	0.5
Giardia lamblia	Cathepsin B precursor	0.0161	0.0999	0.2641
Entamoeba histolytica	cysteine proteinase, putative	0.0385	0.2781	0.4054
Trypanosoma cruzi	cysteine proteinase, putative	0.0385	0.2781	0.2781
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0161	0.0999	0.1852
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0161	0.0999	0.1852
Plasmodium vivax	vivapain-3	0.0385	0.2781	0.5155
Trypanosoma cruzi	cysteine proteinase, putative	0.0385	0.2781	0.2781
Onchocerca volvulus		0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0161	0.0999	0.1852
Loa Loa (eye worm)	ctsf protein	0.0715	0.5394	0.5394
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0715	0.5394	0.5394
Entamoeba histolytica	cysteine protease, putative	0.0715	0.5394	1
Schistosoma mansoni	hypothetical protein	0.0047	0.0096	0.0096
Schistosoma mansoni	hypothetical protein	0.0175	0.1117	0.1117
Brugia malayi	TAR-binding protein	0.0062	0.0214	0.0214
Onchocerca volvulus		0.0715	0.5394	1
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0161	0.0999	0.1852
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1296	1	1
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0161	0.0999	0.0999
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0715	0.5394	0.5394
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Schistosoma mansoni	hypothetical protein	0.0175	0.1117	0.1117
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Brugia malayi	Cathepsin L-like precursor	0.0225	0.1508	0.1508
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0225	0.1508	0.1508
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0715	0.5394	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0225	0.1508	0.1508
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0385	0.2781	0.5155
Loa Loa (eye worm)	hypothetical protein	0.0229	0.1541	0.1541
Loa Loa (eye worm)	hypothetical protein	0.049	0.3612	0.3612
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1296	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Echinococcus granulosus	cathepsin l1	0.049	0.3612	0.3612
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0161	0.0999	0.1852
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0512	0.3783	0.7013
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.0999	0.0999
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Giardia lamblia	Cysteine protease	0.0161	0.0999	0.2641
Brugia malayi	Cathepsin L-like precursor	0.049	0.3612	0.3612
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Giardia lamblia	Cysteine protease	0.0161	0.0999	0.2641
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Loa Loa (eye worm)	fibroinase	0.0715	0.5394	0.5394
Loa Loa (eye worm)	RNA binding protein	0.0062	0.0214	0.0214
Brugia malayi	cathepsin L-like precursor	0.049	0.3612	0.3612
Brugia malayi	Cathepsin L-like precursor	0.049	0.3612	0.3612
Echinococcus multilocularis	cathepsin L cysteine protease	0.0715	0.5394	0.5394
Echinococcus multilocularis	cathepsin b	0.1296	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0385	0.2781	0.5155
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0385	0.2781	0.2781
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Onchocerca volvulus		0.0047	0.0096	0.0179
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0214	0.0214
Loa Loa (eye worm)	hypothetical protein	0.0225	0.1508	0.1508
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Giardia lamblia	Hypothetical protein	0.0161	0.0999	0.2641
Echinococcus multilocularis	geminin	0.0175	0.1117	0.1117
Trypanosoma cruzi	cruzipain precursor, putative	0.0715	0.5394	0.5394
Onchocerca volvulus		0.0715	0.5394	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0161	0.0999	0.1852
Plasmodium falciparum	serine repeat antigen 3	0.0161	0.0999	0.1852
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0161	0.0999	0.1852
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0161	0.0999	0.2641
Loa Loa (eye worm)	hypothetical protein	0.1296	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.049	0.3612	0.6697
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine proteinase, putative	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Echinococcus granulosus	survival motor neuron protein 1	0.0229	0.1541	0.1541
Entamoeba histolytica	cysteine proteinase, putative	0.049	0.3612	0.5946
Loa Loa (eye worm)	hypothetical protein	0.0161	0.0999	0.0999
Brugia malayi	Cathepsin L-like precursor	0.0715	0.5394	0.5394
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.0999	0.0999
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0715	0.5394	1
Toxoplasma gondii	cathepsin B	0.0512	0.3783	0.7013
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0161	0.0999	0.1852
Giardia lamblia	Cathepsin L-like protease	0.0161	0.0999	0.2641
Leishmania major	cathepsin L-like protease	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Schistosoma mansoni	cathepsin s	0.0225	0.1508	0.1508
Trichomonas vaginalis	conserved hypothetical protein	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0161	0.0999	0.1852
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0715	0.5394	0.5394
Loa Loa (eye worm)	TAR-binding protein	0.0062	0.0214	0.0214
Leishmania major	cysteine peptidase A (CPA)	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1296	1	1
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Onchocerca volvulus	Cathepsin F homolog	0.0715	0.5394	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0715	0.5394	0.5394
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0161	0.0999	0.0999
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.049	0.3612	0.3612
Schistosoma mansoni	microtubule-associated protein tau	0.0714	0.5389	0.5389
Plasmodium vivax	vivapain-2	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Onchocerca volvulus		0.0715	0.5394	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0161	0.0999	0.2641
Echinococcus granulosus	cathepsin L	0.0161	0.0999	0.0999
Schistosoma mansoni	cathepsin C	0.0161	0.0999	0.0999
Brugia malayi	Papain family cysteine protease containing protein	0.0715	0.5394	0.5394
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0385	0.2781	0.2781
Trypanosoma cruzi	major cysteine proteinase, putative	0.0161	0.0999	0.0999
Giardia lamblia	Encystation-specific protease	0.0161	0.0999	0.2641
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0161	0.0999	0.1852
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0214	0.0214
Schistosoma mansoni	survival motor neuron protein	0.0047	0.0096	0.0096
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0161	0.0999	0.0999
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0161	0.0999	0.1852
Giardia lamblia	Cathepsin B precursor	0.0512	0.3783	1
Entamoeba histolytica	cysteine proteinase, putative	0.0385	0.2781	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Plasmodium falciparum	serine repeat antigen 9	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Onchocerca volvulus		0.0715	0.5394	1
Brugia malayi	RNA binding protein	0.0062	0.0214	0.0214
Onchocerca volvulus	Cathepsin L homolog	0.0715	0.5394	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0715	0.5394	0.5394
Plasmodium vivax	serine-repeat antigen (SERA)	0.0161	0.0999	0.1852
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.0999	0.0999
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Plasmodium vivax	serine-repeat antigen (SERA)	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.049	0.3612	0.6697
Giardia lamblia	Cathepsin B precursor	0.0512	0.3783	1
Loa Loa (eye worm)	hypothetical protein	0.049	0.3612	0.3612
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0214	0.0214
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.0999	0.0999
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Toxoplasma gondii	cathepsin CPC2	0.0161	0.0999	0.1852
Mycobacterium leprae	Probable pyruvate kinase PykA	0.0035	0	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0385	0.2781	0.2781
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0225	0.1508	0.1508
Giardia lamblia	Cathepsin L precursor	0.0161	0.0999	0.2641
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0047	0.0096	0.0096
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0161	0.0999	0.0999
Echinococcus granulosus	cysteine protease	0.0385	0.2781	0.2781
Giardia lamblia	Hypothetical protein	0.0161	0.0999	0.2641
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0161	0.0999	0.1852
Echinococcus granulosus	geminin	0.0175	0.1117	0.1117
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0715	0.5394	0.5394
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0161	0.0999	0.1852
Echinococcus multilocularis	cathepsin L cysteine protease	0.0715	0.5394	0.5394
Echinococcus multilocularis	microtubule associated protein 2	0.0714	0.5389	0.5389
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0161	0.0999	0.0999
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0385	0.2781	0.5155
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0214	0.0214
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Plasmodium falciparum	serine repeat antigen 7	0.0161	0.0999	0.1852
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0161	0.0999	0.0999
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0715	0.5394	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Giardia lamblia	Cysteine protease	0.0161	0.0999	0.2641
Schistosoma mansoni	cathepsin F (C01 family)	0.0715	0.5394	0.5394
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0161	0.0999	0.2641
Echinococcus multilocularis	cathepsin L	0.0385	0.2781	0.2781
Echinococcus granulosus	microtubule associated protein 2	0.0714	0.5389	0.5389
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Trypanosoma cruzi	cysteine protease, putative	0.0385	0.2781	0.2781
Plasmodium vivax	unspecified product	0.0161	0.0999	0.1852
Plasmodium falciparum	serine repeat antigen 1	0.0161	0.0999	0.1852
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0715	0.5394	1
Loa Loa (eye worm)	hypothetical protein	0.0715	0.5394	0.5394
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1296	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0715	0.5394	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0385	0.2781	0.2781
Loa Loa (eye worm)	cysteine protease	0.0715	0.5394	0.5394
Onchocerca volvulus		0.0161	0.0999	0.1852
Echinococcus multilocularis	tar DNA binding protein	0.0062	0.0214	0.0214
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0161	0.0999	0.1852
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0715	0.5394	1
Giardia lamblia	Cysteine protease	0.0161	0.0999	0.2641
Entamoeba histolytica	cysteine protease, putative	0.0385	0.2781	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.049	0.3612	0.3612

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2.85 uM	Inhibition of human phosphoenolpyruvate carboxykinase (PEPCK).	ChEMBL.	14552798

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

PubChem: 10005328

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 220871