TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 574.567 | Formula: C29H30F4N4O4
H donors: 1 H acceptors: 4 LogP: 2.14 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: [O-]C(=O)C(F)(F)F.F[C@H]1CCN(C1)C(=O)[C@H]([C@@H](C(=O)N(C)C)c1ccc(cc1)c1ccc(cc1)[n+]1ccccc1)N
InChi: 1S/C27H30FN4O2.C2HF3O2/c1-30(2)26(33)24(25(29)27(34)32-17-14-22(28)18-32)21-8-6-19(7-9-21)20-10-12-23(13-11-20)31-15-4-3-5-16-31;3-2(4,5)1(6)7/h3-13,15-16,22,24-25H,14,17-18,29H2,1-2H3;(H,6,7)/q+1;/p-1/t22-,24-,25-;/m0./s1
InChiKey: AZNPLAYPWLZJFS-IUXZIFGMSA-M

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
Homo sapiens	dipeptidyl-peptidase 4	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	dipeptidyl aminopeptidase B	Get druggable targets OG5_128614	All targets in OG5_128614
Candida albicans	dipeptidyl aminopeptidase B	Get druggable targets OG5_128614	All targets in OG5_128614
Loa Loa (eye worm)	prolyl oligopeptidase	Get druggable targets OG5_128614	All targets in OG5_128614
Onchocerca volvulus	Dipeptidyl peptidase family member 1 homolog	Get druggable targets OG5_128614	All targets in OG5_128614
Echinococcus granulosus	dipeptidyl aminopeptidaseprotein	Get druggable targets OG5_128614	All targets in OG5_128614
Echinococcus multilocularis	dipeptidyl aminopeptidaseprotein	Get druggable targets OG5_128614	All targets in OG5_128614
Schistosoma mansoni	subfamily S9B unassigned peptidase (S09 family)	Get druggable targets OG5_128614	All targets in OG5_128614
Brugia malayi	prolyl oligopeptidase family protein	Get druggable targets OG5_128614	All targets in OG5_128614
Schistosoma japonicum	ko:K01278 dipeptidyl-peptidase 4, putative	Get druggable targets OG5_128614	All targets in OG5_128614

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
Plasmodium vivax	vivapain-1	0.0553	0.2994	0.4054
Onchocerca volvulus	Cathepsin L homolog	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Giardia lamblia	Cathepsin B precursor	0.0659	0.3685	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.1033	0.6127	1
Brugia malayi	fibroinase precursor	0.0226	0.0858	0.0711
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0553	0.2994	0.2994
Trypanosoma cruzi	cysteine peptidase, putative	0.1033	0.6127	0.5764
Trypanosoma cruzi	cysteine proteinase, putative	0.0553	0.2994	0.2337
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.06	0.33	0.3193
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0561	0.3042	0.4832
Onchocerca volvulus	Cathepsin L homolog	0.1033	0.6127	1
Entamoeba histolytica	cysteine proteinase 2	0.0553	0.2994	0.4054
Echinococcus multilocularis	cathepsin L	0.0553	0.2994	0.2882
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0174	0.0517	0.0517
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0226	0.0858	0.0711
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0553	0.2994	0.2337
Brugia malayi	Cathepsin L-like precursor	0.0327	0.1519	0.1383
Loa Loa (eye worm)	cysteine protease	0.1033	0.6127	0.6065
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1033	0.6127	0.6065
Trichomonas vaginalis	conserved hypothetical protein	0.0226	0.0858	0.1173
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Onchocerca volvulus		0.1033	0.6127	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0226	0.0858	0.0858
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0226	0.0858	0.1173
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0561	0.3042	0.4832
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1033	0.6127	0.6065
Brugia malayi	Papain family cysteine protease containing protein	0.0226	0.0858	0.0711
Brugia malayi	cathepsin F-like cysteine proteinase	0.0226	0.0858	0.0711
Brugia malayi	cathepsin L-like cysteine proteinase	0.0226	0.0858	0.0711
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0553	0.2994	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.1033	0.6127	0.5764
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1033	0.6127	0.6065
Brugia malayi	cathepsin L precursor	0.0226	0.0858	0.0711
Brugia malayi	Papain family cysteine protease containing protein	0.0226	0.0858	0.0711
Loa Loa (eye worm)	hypothetical protein	0.1033	0.6127	0.6065
Entamoeba histolytica	cysteine proteinase, putative	0.1033	0.6127	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0659	0.3685	0.3685
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1627	1	1
Plasmodium vivax	vivapain-2	0.1033	0.6127	1
Echinococcus multilocularis	voltage gated potassium channel	0.0174	0.0517	0.0366
Entamoeba histolytica	cysteine proteinase, putative	0.0553	0.2994	0.4054
Onchocerca volvulus	Cathepsin L homolog	0.0226	0.0858	0.0204
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.06	0.33	0.3193
Schistosoma mansoni	cathepsin F (C01 family)	0.1033	0.6127	0.6127
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0226	0.0858	0.1173
Schistosoma mansoni	cathepsin F (C01 family)	0.1033	0.6127	0.6127
Echinococcus multilocularis	cysteine protease	0.1033	0.6127	0.6065
Onchocerca volvulus		0.1033	0.6127	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.1033	0.6127	0.6065
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0706	0.3991	0.3427
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0553	0.2994	0.2994
Plasmodium vivax	unspecified product	0.0553	0.2994	0.4054
Plasmodium vivax	vivapain-2	0.1033	0.6127	1
Onchocerca volvulus		0.1033	0.6127	1
Trypanosoma cruzi	cruzipain precursor, putative	0.1033	0.6127	0.5764
Brugia malayi	Cathepsin L-like precursor	0.0706	0.3991	0.3894
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Brugia malayi	cathepsin L-like precursor	0.0706	0.3991	0.3894
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.1033	0.6127	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0327	0.1519	0.1383
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Onchocerca volvulus		0.1033	0.6127	1
Echinococcus multilocularis	cysteine protease	0.1033	0.6127	0.6065
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0706	0.3991	0.3894
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0174	0.0517	0.0366
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0553	0.2994	0.2337
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1033	0.6127	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.0553	0.2994	0.4054
Schistosoma mansoni	cathepsin S (C01 family)	0.0226	0.0858	0.0858
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.0706	0.3991	0.3991
Echinococcus multilocularis	cathepsin L cysteine protease	0.1033	0.6127	0.6065
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.06	0.33	0.3193
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0226	0.0858	0.1173
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0119	0.0157	0.0157
Loa Loa (eye worm)	hypothetical protein	0.0706	0.3991	0.3894
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Echinococcus granulosus	dipeptidyl aminopeptidaseprotein	0.0209	0.0748	0.06
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Loa Loa (eye worm)	cathepsin B	0.0659	0.3685	0.3584
Trypanosoma cruzi	cruzipain precursor, putative	0.0327	0.1519	0.0723
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Schistosoma mansoni	cathepsin C	0.0226	0.0858	0.0858
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1627	1	1
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0119	0.0157	0.0157
Trypanosoma cruzi	cysteine peptidase, putative	0.1033	0.6127	0.5764
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0226	0.0858	0.0858
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Plasmodium vivax	unspecified product	0.0327	0.1519	0.1254
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065
Trypanosoma cruzi	cysteine peptidase, putative	0.0327	0.1519	0.0723
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0706	0.3991	0.6421
Entamoeba histolytica	cysteine protease, putative	0.1033	0.6127	1
Loa Loa (eye worm)	fibroinase	0.1033	0.6127	0.6065
Echinococcus granulosus	cysteine protease	0.0553	0.2994	0.2882
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Loa Loa (eye worm)	hypothetical protein	0.0174	0.0517	0.0366
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0858	0.0711
Onchocerca volvulus		0.1033	0.6127	1
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Giardia lamblia	Cathepsin B precursor	0.0659	0.3685	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.06	0.33	0.3193
Trichomonas vaginalis	conserved hypothetical protein	0.0226	0.0858	0.1173
Echinococcus granulosus	voltage gated potassium channel	0.0174	0.0517	0.0366
Brugia malayi	prolyl oligopeptidase family protein	0.0209	0.0748	0.06
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0226	0.0858	0.0711
Echinococcus multilocularis	cathepsin b	0.1627	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0119	0.0157	0.0157
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0226	0.0858	0.0711
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1627	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0226	0.0858	0.0711
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1627	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0226	0.0858	0.0858
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0226	0.0858	0.1173
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Brugia malayi	Papain family cysteine protease containing protein	0.1033	0.6127	0.6065
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0226	0.0858	0.0858
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Brugia malayi	Cathepsin L-like precursor	0.0706	0.3991	0.3894
Echinococcus multilocularis	cathepsin b	0.1627	1	1
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Toxoplasma gondii	cathepsin CPL	0.1033	0.6127	1
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Loa Loa (eye worm)	ctsf protein	0.1033	0.6127	0.6065
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0226	0.0858	0.0858
Echinococcus multilocularis	dipeptidyl aminopeptidaseprotein	0.0209	0.0748	0.06
Echinococcus granulosus	cathepsin l1	0.1033	0.6127	0.6065
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0226	0.0858	0.0711
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0226	0.0858	0.0858
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0226	0.0858	0.1173
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0226	0.0858	0.0858
Loa Loa (eye worm)	hypothetical protein	0.0327	0.1519	0.1383
Onchocerca volvulus		0.0226	0.0858	0.0204
Onchocerca volvulus	Cathepsin F homolog	0.1033	0.6127	1
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Toxoplasma gondii	cathepsin B	0.0659	0.3685	0.5366
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.0553	0.2994	0.2337
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0327	0.1519	0.1383
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0226	0.0858	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0521	0.2783	0.2667
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Echinococcus granulosus	cathepsin b	0.1627	1	1
Leishmania major	cysteine peptidase A (CPA)	0.1033	0.6127	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0659	0.3685	0.3093
Entamoeba histolytica	cysteine proteinase, putative	0.0553	0.2994	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0226	0.0858	0.1173
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0174	0.0517	0.0366
Schistosoma mansoni	voltage-gated potassium channel	0.0655	0.366	0.366
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0327	0.1519	0.1383
Schistosoma mansoni	cathepsin B (C01 family)	0.0226	0.0858	0.0858
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1627	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Plasmodium vivax	vivapain-3	0.0553	0.2994	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0659	0.3685	0.591
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.1033	0.6127	0.6065
Echinococcus multilocularis	cathepsin L	0.0226	0.0858	0.0711
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0119	0.0157	0.0157
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0226	0.0858	0.1173
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Brugia malayi	Papain family cysteine protease containing protein	0.0553	0.2994	0.2882
Schistosoma mansoni	subfamily S9B unassigned peptidase (S09 family)	0.0209	0.0748	0.0748
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0174	0.0517	0.0366
Loa Loa (eye worm)	hypothetical protein	0.0327	0.1519	0.1383
Onchocerca volvulus		0.1033	0.6127	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.1033	0.6127	0.6065
Brugia malayi	Papain family cysteine protease containing protein	0.0553	0.2994	0.2882
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0706	0.3991	0.6421
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0655	0.366	0.366
Loa Loa (eye worm)	hypothetical protein	0.0706	0.3991	0.3894
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0119	0.0157	0.0157
Loa Loa (eye worm)	prolyl oligopeptidase	0.0209	0.0748	0.06
Onchocerca volvulus		0.0706	0.3991	0.6029
Onchocerca volvulus		0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0553	0.2994	0.4751
Loa Loa (eye worm)	hypothetical protein	0.0327	0.1519	0.1383
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0226	0.0858	0.0858
Schistosoma mansoni	cathepsin s	0.0327	0.1519	0.1519
Loa Loa (eye worm)	hypothetical protein	0.0706	0.3991	0.3894
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0659	0.3685	0.2207
Echinococcus granulosus	cathepsin l1	0.0706	0.3991	0.3894
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0226	0.0858	0.1173
Echinococcus granulosus	cathepsin b	0.1627	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.1033	0.6127	0.6065
Echinococcus granulosus	cathepsin L	0.0226	0.0858	0.0711
Entamoeba histolytica	cysteine proteinase, putative	0.0553	0.2994	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.1033	0.6127	0.5764
Entamoeba histolytica	cysteine proteinase, putative	0.1033	0.6127	1
Entamoeba histolytica	cysteine protease, putative	0.0553	0.2994	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0553	0.2994	0.4751
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0226	0.0858	0.1173
Echinococcus granulosus	cathepsin L cysteine protease	0.0553	0.2994	0.2882
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0119	0.0157	0.0157
Schistosoma mansoni	voltage-gated potassium channel	0.0174	0.0517	0.0517
Entamoeba histolytica	cysteine proteinase, putative	0.0706	0.3991	0.5946
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1033	0.6127	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0226	0.0858	0.1173
Giardia lamblia	Cathepsin B precursor	0.0659	0.3685	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0553	0.2994	0.2994
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0226	0.0858	0.0711
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1033	0.6127	1
Entamoeba histolytica	cysteine proteinase, putative	0.0553	0.2994	0.4054
Loa Loa (eye worm)	hypothetical protein	0.1627	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0858	0.1173
Trypanosoma cruzi	cysteine protease, putative	0.0553	0.2994	0.2337
Echinococcus granulosus	cathepsin L	0.0553	0.2994	0.2882
Leishmania major	cathepsin L-like protease	0.1033	0.6127	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0226	0.0858	0.0711
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0226	0.0858	0.0858
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1033	0.6127	1
Brugia malayi	Cathepsin L-like precursor	0.1033	0.6127	0.6065

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.02 uM	Inhibitory concentration against dipeptidyl-peptidase IV	ChEMBL.	15908206
IC50 (binding)	= 89 uM	Inhibitory concentration against dipeptidyl-peptidase II (QPP)	ChEMBL.	15908206
IC50 (binding)	> 100 uM	Inhibitory concentration against dipeptidyl-peptidase 8	ChEMBL.	15908206
IC50 (binding)	= 100 uM	Inhibitory concentration against dipeptidyl-peptidase 9	ChEMBL.	15908206

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: CHEMBL552503

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1044300