TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 765.897 | Formula: C37H48FN9O6S
H donors: 5 H acceptors: 7 LogP: 3.7 Rotable bonds: 20
Rule of 5 violations (Lipinski): 2
SMILES: O=C(N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCN(CC1)c1nsc2c1cccc2)C(C)C)CNC(=O)[C@H](C(C)C)NC(=O)CNC(=O)Nc1ccc(cc1)F
InChi: 1S/C37H48FN9O6S/c1-22(2)31(42-30(49)21-40-37(53)41-25-13-11-24(38)12-14-25)34(50)39-20-29(48)43-32(23(3)4)36(52)47-15-7-9-27(47)35(51)46-18-16-45(17-19-46)33-26-8-5-6-10-28(26)54-44-33/h5-6,8,10-14,22-23,27,31-32H,7,9,15-21H2,1-4H3,(H,39,50)(H,42,49)(H,43,48)(H2,40,41,53)/t27-,31-,32-/m0/s1
InChiKey: JSTCQRCWUFCXPX-GFLPGQDNSA-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
Loa Loa (eye worm)	fibroinase	0.1628	0.5408	0.5406
Giardia lamblia	Cathepsin B precursor	0.0366	0.1143	0.2939
Giardia lamblia	Cathepsin B precursor	0.1177	0.3882	1
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0044	0.0052	0.0049
Echinococcus multilocularis	voltage gated potassium channel	0.0064	0.0121	0.0118
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0366	0.1143	0.2939
Brugia malayi	Intermediate filament tail domain containing protein	0.005	0.0074	0.0071
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Onchocerca volvulus		0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0878	0.2872	0.5308
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0366	0.1143	0.1141
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Echinococcus granulosus	cathepsin b	0.2986	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0366	0.1143	0.1141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Giardia lamblia	Encystation-specific protease	0.0366	0.1143	0.2939
Mycobacterium ulcerans	hypothetical protein	0.0029	0.0003	0.5
Mycobacterium leprae	Conserved hypothetical protein	0.0029	0.0003	0.5
Loa Loa (eye worm)	hypothetical protein	0.1116	0.3679	0.3677
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0044	0.0052	0.0049
Onchocerca volvulus		0.1628	0.5408	1
Mycobacterium ulcerans	transmembrane transport protein	0.0029	0.0003	0.5
Echinococcus granulosus	voltage gated potassium channel	0.0064	0.0121	0.0121
Echinococcus granulosus	cathepsin L	0.0878	0.2872	0.2872
Brugia malayi	cathepsin L precursor	0.0366	0.1143	0.1141
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0064	0.0121	0.0118
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0044	0.0052	0.0049
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0366	0.1143	0.211
Plasmodium vivax	unspecified product	0.0366	0.1143	0.211
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0004	0.0001
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0511	0.1633	0.1631
Mycobacterium tuberculosis	Conserved protein	0.0029	0.0003	0.5
Loa Loa (eye worm)	hypothetical protein	0.2986	1	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0366	0.1143	0.1141
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0878	0.2872	0.287
Mycobacterium tuberculosis	Probable transcriptional regulatory protein Cmr	0.0029	0.0003	0.5
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0044	0.0052	0.0049
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.0192	0.0554	0.0551
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0221	0.0652	0.065
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Toxoplasma gondii	cathepsin CPC2	0.0366	0.1143	0.211
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0366	0.1143	0.211
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Echinococcus granulosus	cathepsin L	0.0366	0.1143	0.1143
Giardia lamblia	Hypothetical protein	0.0366	0.1143	0.2939
Treponema pallidum	catabolite gene activator (Crp)	0.0029	0.0003	0.5
Toxoplasma gondii	cathepsin B	0.1177	0.3882	0.7178
Schistosoma mansoni	cathepsin s	0.0511	0.1633	0.1631
Onchocerca volvulus		0.1628	0.5408	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Schistosoma mansoni	voltage-gated potassium channel	0.0064	0.0121	0.0118
Onchocerca volvulus		0.1628	0.5408	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Plasmodium vivax	vivapain-1	0.0878	0.2872	0.5308
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1116	0.3679	0.6801
Echinococcus granulosus	cathepsin l cysteine peptidase	0.1628	0.5408	0.5408
Brugia malayi	Pre-SET motif family protein	0.0205	0.0599	0.0596
Trypanosoma cruzi	cysteine peptidase, putative	0.0878	0.2872	0.287
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0004	0.0002
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.1628	0.5408	0.5406
Onchocerca volvulus		0.1628	0.5408	1
Trypanosoma cruzi	major cysteine proteinase, putative	0.0366	0.1143	0.1141
Echinococcus granulosus	patatin phospholipase domain containing protein	0.0029	0.0003	0.0003
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.1177	0.3882	0.7178
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Plasmodium vivax	serine-repeat antigen (SERA)	0.0366	0.1143	0.211
Giardia lamblia	Cathepsin B precursor	0.1177	0.3882	1
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0044	0.0052	0.0049
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0366	0.1143	0.211
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.1628	0.5408	1
Giardia lamblia	Cysteine protease	0.0366	0.1143	0.2939
Brugia malayi	Cathepsin L-like precursor	0.1116	0.3679	0.3677
Plasmodium vivax	unspecified product	0.0878	0.2872	0.5308
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0044	0.0052	0.0091
Plasmodium falciparum	serine repeat antigen 8	0.0366	0.1143	0.211
Brugia malayi	Pre-SET motif family protein	0.0029	0.0004	0.0001
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0511	0.1633	0.1631
Giardia lamblia	Cathepsin L-like protease	0.0366	0.1143	0.2939
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.1177	0.3882	0.7178
Leishmania major	cysteine peptidase A (CPA)	0.1628	0.5408	1
Loa Loa (eye worm)	cysteine protease	0.1628	0.5408	0.5406
Onchocerca volvulus		0.1628	0.5408	1
Onchocerca volvulus		0.005	0.0074	0.0132
Echinococcus granulosus	cysteine protease	0.0878	0.2872	0.2872
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0366	0.1143	0.1141
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.005	0.0074	0.0071
Echinococcus multilocularis	cathepsin L cysteine protease	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0878	0.2872	0.5308
Echinococcus granulosus	cathepsin L cysteine proteinase	0.1628	0.5408	0.5408
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0044	0.0052	0.0052
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0366	0.1143	0.1141
Mycobacterium tuberculosis	Probable conserved transmembrane protein	0.0029	0.0003	0.5
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Loa Loa (eye worm)	hypothetical protein	0.005	0.0074	0.0071
Loa Loa (eye worm)	ctsf protein	0.1628	0.5408	0.5406
Brugia malayi	Cathepsin L-like precursor	0.1116	0.3679	0.3677
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.1628	0.5408	1
Plasmodium vivax	vivapain-2	0.1628	0.5408	1
Entamoeba histolytica	cysteine protease, putative	0.1628	0.5408	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0878	0.2872	0.287
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1628	0.5408	0.5406
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0366	0.1143	0.2939
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0878	0.2872	0.5308
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Trichomonas vaginalis	conserved hypothetical protein	0.0366	0.1143	0.211
Mycobacterium ulcerans	hypothetical protein	0.0029	0.0003	0.5
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0366	0.1143	0.1141
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0366	0.1143	0.211
Schistosoma mansoni	intermediate filament proteins	0.005	0.0074	0.0071
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0029	0.0003	0.0003
Brugia malayi	cathepsin F-like cysteine proteinase	0.0511	0.1633	0.1631
Entamoeba histolytica	cysteine proteinase, putative	0.0878	0.2872	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0044	0.0052	0.0049
Trypanosoma cruzi	cysteine peptidase, putative	0.1628	0.5408	0.5406
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Onchocerca volvulus		0.1628	0.5408	1
Echinococcus granulosus	lamin	0.005	0.0074	0.0074
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0044	0.0052	0.0052
Schistosoma mansoni	cathepsin F (C01 family)	0.1116	0.3679	0.3677
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0004	0.0001
Trypanosoma cruzi	cysteine protease, putative	0.0878	0.2872	0.287
Schistosoma mansoni	voltage-gated potassium channel	0.0242	0.0721	0.0719
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0044	0.0052	0.0091
Treponema pallidum	catabolite gene activator	0.0029	0.0003	0.5
Brugia malayi	Papain family cysteine protease containing protein	0.1628	0.5408	0.5406
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.2986	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0366	0.1143	0.1141
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Schistosoma mansoni	voltage-gated potassium channel	0.0044	0.0052	0.0049
Giardia lamblia	Cysteine protease	0.0366	0.1143	0.2939
Loa Loa (eye worm)	hypothetical protein	0.1116	0.3679	0.3677
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0366	0.1143	0.1141
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0366	0.1143	0.211
Echinococcus granulosus	hyperpolarization activated cyclic	0.0044	0.0052	0.0052
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Giardia lamblia	Cysteine protease	0.0366	0.1143	0.2939
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0878	0.2872	0.4054
Schistosoma mansoni	lamin	0.005	0.0074	0.0071
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Trypanosoma cruzi	major cysteine proteinase, putative	0.0366	0.1143	0.1141
Brugia malayi	cathepsin F-like cysteine proteinase	0.0366	0.1143	0.1141
Onchocerca volvulus	Cathepsin F homolog	0.1628	0.5408	1
Schistosoma mansoni	lamin	0.005	0.0074	0.0071
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0029	0.0003	0.0003
Trichomonas vaginalis	set domain proteins, putative	0.0234	0.0695	0.128
Plasmodium falciparum	serine repeat antigen 4	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0044	0.0052	0.0049
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0044	0.0052	0.0049
Trypanosoma cruzi	cruzipain precursor, putative	0.0511	0.1633	0.1631
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0221	0.0652	0.065
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.1628	0.5408	1
Toxoplasma gondii	cathepsin CPL	0.1628	0.5408	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0366	0.1143	0.211
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Plasmodium vivax	SET domain protein, putative	0.0029	0.0004	0.0002
Echinococcus granulosus	cAMP dependent protein kinase type II regulatory	0.0029	0.0003	0.0003
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0004	0.0001
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0044	0.0052	0.0049
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1628	0.5408	1
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Entamoeba histolytica	cysteine proteinase, putative	0.0878	0.2872	0.4054
Mycobacterium ulcerans	regulatory protein	0.0029	0.0003	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0511	0.1633	0.1631
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0366	0.1143	0.211
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0029	0.0003	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0878	0.2872	0.5308
Entamoeba histolytica	cysteine proteinase 1, putative	0.0878	0.2872	0.4054
Echinococcus multilocularis	cysteine protease	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Echinococcus granulosus	cGMP dependent protein kinase	0.0029	0.0003	0.0003
Echinococcus multilocularis	cathepsin L	0.0878	0.2872	0.287
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Brugia malayi	fibroinase precursor	0.0366	0.1143	0.1141
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Toxoplasma gondii	cathepsin CPC1	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Giardia lamblia	Hypothetical protein	0.0366	0.1143	0.2939
Entamoeba histolytica	cysteine proteinase, putative	0.1116	0.3679	0.5946
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1177	0.3882	0.3881
Plasmodium falciparum	serine repeat antigen 5	0.0366	0.1143	0.211
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Plasmodium vivax	vivapain-2	0.1628	0.5408	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2986	1	1
Schistosoma mansoni	voltage-gated potassium channel	0.0064	0.0121	0.0118
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0366	0.1143	0.211
Echinococcus multilocularis	cathepsin L	0.0366	0.1143	0.1141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2986	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0878	0.2872	0.287
Entamoeba histolytica	cysteine proteinase, putative	0.0878	0.2872	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0366	0.1143	0.211
Trypanosoma cruzi	cysteine proteinase, putative	0.0878	0.2872	0.287
Plasmodium falciparum	serine repeat antigen 6	0.0366	0.1143	0.211
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0366	0.1143	0.211
Onchocerca volvulus	Cathepsin L homolog	0.1628	0.5408	1
Trypanosoma cruzi	cysteine peptidase, putative	0.1628	0.5408	0.5406
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0878	0.2872	0.287
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Echinococcus multilocularis	cysteine protease	0.1628	0.5408	0.5406
Trypanosoma cruzi	cysteine peptidase, putative	0.1628	0.5408	0.5406
Echinococcus granulosus	cAMP dependent protein kinase regulatory	0.0029	0.0003	0.0003
Echinococcus granulosus	cAMP dependent protein kinase type I beta	0.0029	0.0003	0.0003
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0366	0.1143	0.1141
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0366	0.1143	0.211
Onchocerca volvulus		0.1116	0.3679	0.6801
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0366	0.1143	0.211
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0071	0.0068
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1177	0.3882	0.3881
Plasmodium vivax	vivapain-3	0.0878	0.2872	0.5308
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0366	0.1143	0.211
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Plasmodium vivax	serine-repeat antigen (SERA)	0.0366	0.1143	0.211
Onchocerca volvulus	Cathepsin L homolog	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.0511	0.1633	0.1631
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Chlamydia trachomatis	cAMP-dependent protein kinase regulatory subunit	0.0029	0.0003	0.5
Brugia malayi	Papain family cysteine protease containing protein	0.0878	0.2872	0.287
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0044	0.0052	0.0049
Loa Loa (eye worm)	intermediate filament protein	0.005	0.0074	0.0071
Echinococcus granulosus	cathepsin b	0.2986	1	1
Giardia lamblia	Cathepsin B precursor	0.0366	0.1143	0.2939
Mycobacterium ulcerans	hypothetical protein	0.0029	0.0003	0.5
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0004	0.0004
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Onchocerca volvulus		0.0029	0.0004	0.0002
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0366	0.1143	0.211
Brugia malayi	cathepsin L-like precursor	0.1116	0.3679	0.3677
Schistosoma mansoni	cathepsin F (C01 family)	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Treponema pallidum	cyclic nucleotide binding protein	0.0029	0.0003	0.5
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0044	0.0052	0.0052
Onchocerca volvulus		0.005	0.0074	0.0132
Giardia lamblia	Cathepsin L-like protease	0.0366	0.1143	0.2939
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0366	0.1143	0.211
Trypanosoma cruzi	cysteine proteinase, putative	0.0878	0.2872	0.287
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.1116	0.3679	0.3677
Mycobacterium ulcerans	hypothetical protein	0.0029	0.0003	0.5
Trypanosoma cruzi	cruzipain precursor, putative	0.1628	0.5408	0.5406
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0029	0.0003	0.0003
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0221	0.0652	0.065
Brugia malayi	Papain family cysteine protease containing protein	0.0878	0.2872	0.287
Giardia lamblia	Cathepsin B precursor	0.0366	0.1143	0.2939
Plasmodium vivax	unspecified product	0.0511	0.1633	0.3016
Loa Loa (eye worm)	cathepsin B	0.1177	0.3882	0.3881
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0366	0.1143	0.211
Brugia malayi	Cathepsin L-like cysteine proteinase	0.1116	0.3679	0.3677
Plasmodium falciparum	serine repeat antigen 7	0.0366	0.1143	0.211
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0004	0.0001
Trypanosoma cruzi	cysteine peptidase, putative	0.1628	0.5408	0.5406
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1116	0.3679	0.6801
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0064	0.0121	0.0118
Echinococcus granulosus	lamin dm0	0.005	0.0074	0.0074
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Giardia lamblia	Cathepsin B precursor	0.1177	0.3882	1
Plasmodium falciparum	serine repeat antigen 3	0.0366	0.1143	0.211
Entamoeba histolytica	cysteine proteinase 2	0.0878	0.2872	0.4054
Echinococcus multilocularis	lamin	0.005	0.0074	0.0071
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0366	0.1143	0.211
Brugia malayi	cathepsin L-like cysteine proteinase	0.0366	0.1143	0.1141
Trichomonas vaginalis	conserved hypothetical protein	0.0366	0.1143	0.211
Onchocerca volvulus	Cathepsin L homolog	0.0366	0.1143	0.211
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0366	0.1143	0.2939
Echinococcus multilocularis	lamin dm0	0.005	0.0074	0.0071
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0366	0.1143	0.1141
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Onchocerca volvulus		0.1628	0.5408	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0029	0.0003	0.5
Echinococcus granulosus	cathepsin l1	0.1116	0.3679	0.3679
Brugia malayi	Papain family cysteine protease containing protein	0.0366	0.1143	0.1141
Loa Loa (eye worm)	hypothetical protein	0.0511	0.1633	0.1631
Brugia malayi	intermediate filament protein	0.005	0.0074	0.0071
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0366	0.1143	0.211
Echinococcus granulosus	intermediate filament protein	0.005	0.0074	0.0074
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Treponema pallidum	cyclic nucleotide binding protein	0.0029	0.0003	0.5
Mycobacterium tuberculosis	Probable conserved transmembrane transport protein	0.0029	0.0003	0.5
Schistosoma mansoni	voltage-gated potassium channel	0.0035	0.0022	0.0019
Giardia lamblia	Cathepsin B precursor	0.0366	0.1143	0.2939
Loa Loa (eye worm)	hypothetical protein	0.0511	0.1633	0.1631
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0366	0.1143	0.1141
Echinococcus granulosus	cathepsin L cysteine protease	0.0878	0.2872	0.2872
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0004	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Giardia lamblia	Cysteine protease	0.0366	0.1143	0.2939
Mycobacterium ulcerans	transcriptional regulatory protein	0.0029	0.0003	0.5
Plasmodium falciparum	serine repeat antigen 1	0.0366	0.1143	0.211
Giardia lamblia	Cathepsin B precursor	0.0366	0.1143	0.2939
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0366	0.1143	0.211
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0366	0.1143	0.1141
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0366	0.1143	0.1141
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Brugia malayi	Cathepsin L-like precursor	0.0511	0.1633	0.1631
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Plasmodium falciparum	serine repeat antigen 9	0.0366	0.1143	0.211
Leishmania major	cathepsin L-like protease	0.1628	0.5408	1
Echinococcus multilocularis	cathepsin b	0.2986	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0366	0.1143	0.211
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.1116	0.3679	0.3677
Echinococcus granulosus	hyperpolarization activated cyclic	0.0044	0.0052	0.0052
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0064	0.0121	0.0121
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0044	0.0052	0.0049
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.1628	0.5408	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0044	0.0052	0.0049
Giardia lamblia	Cathepsin L precursor	0.0366	0.1143	0.2939
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.1628	0.5408	1
Schistosoma mansoni	cathepsin B (C01 family)	0.0366	0.1143	0.1141
Schistosoma mansoni	cathepsin F (C01 family)	0.1628	0.5408	0.5406
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0044	0.0052	0.0049
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.1628	0.5408	0.5406
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0366	0.1143	0.2939
Schistosoma mansoni	voltage-gated potassium channel	0.0242	0.0721	0.0719
Entamoeba histolytica	cysteine protease, putative	0.0878	0.2872	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.1628	0.5408	1
Brugia malayi	Papain family cysteine protease containing protein	0.0366	0.1143	0.1141
Onchocerca volvulus		0.0234	0.0695	0.128
Mycobacterium tuberculosis	Probable glutamine-transport ATP-binding protein ABC transporter GlnQ	0.0029	0.0003	0.5
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0121	0.0118
Brugia malayi	Papain family cysteine protease containing protein	0.0366	0.1143	0.1141
Schistosoma mansoni	cathepsin C	0.0366	0.1143	0.1141
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.1628	0.5408	0.5406
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0044	0.0052	0.0052
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2986	1	1
Loa Loa (eye worm)	hypothetical protein	0.0366	0.1143	0.1141
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.2986	1	1
Schistosoma mansoni	60S ribosomal protein L21	0.0035	0.0022	0.0019
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0366	0.1143	0.211
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0366	0.1143	0.211
Schistosoma mansoni	cathepsin S (C01 family)	0.0366	0.1143	0.1141
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Brugia malayi	Cathepsin L-like precursor	0.1628	0.5408	0.5406
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0207	0.0603	0.1111
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0878	0.2872	0.5308
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0205	0.0599	0.0596
Echinococcus multilocularis	cathepsin L cysteine protease	0.1628	0.5408	0.5406
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0366	0.1143	0.1141
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0004	0.0001
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.1628	0.5408	0.5406
Echinococcus granulosus	cathepsin l1	0.1628	0.5408	0.5408
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Plasmodium falciparum	serine repeat antigen 2	0.0366	0.1143	0.211
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0004	0.0001
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0366	0.1143	0.1141
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0221	0.0652	0.0652
Entamoeba histolytica	cysteine proteinase, putative	0.1628	0.5408	1
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0052	0.0049
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0207	0.0603	0.1111
Echinococcus multilocularis	cathepsin b	0.2986	1	1
Trypanosoma brucei	cysteine peptidase C (CPC)	0.1177	0.3882	0.7178
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1628	0.5408	1
Echinococcus multilocularis	musashi	0.005	0.0074	0.0071

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 39 uM	Inhibition of jack bean urease assessed as reduction in ammonia production incubated at 30 degC for 15 mins by indophenol method	ChEMBL.	25305332
IZ (functional)	= 30 mm	Antibacterial activity against Escherichia coli at 50 ug/mL incubated for 24 hrs by agar well diffusion method	ChEMBL.	25305332

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

ChEMBL: CHEMBL3344248

Bibliographic References

No literature references available for this target.

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Detailed information for compound 936619