TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 816.899 | Formula: C41H52N8O10
H donors: 9 H acceptors: 9 LogP: 0.35 Rotable bonds: 26
Rule of 5 violations (Lipinski): 3
SMILES: OC[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)OC)N)C
InChi: 1S/C41H52N8O10/c1-24(45-38(55)30(42)19-26-12-16-29(59-2)17-13-26)37(54)47-31(20-25-7-4-3-5-8-25)39(56)44-22-35(52)46-32(21-27-10-14-28(51)15-11-27)41(58)49-18-6-9-34(49)40(57)48-33(23-50)36(43)53/h3-5,7-8,10-17,24,30-34,50-51H,6,9,18-23,42H2,1-2H3,(H2,43,53)(H,44,56)(H,45,55)(H,46,52)(H,47,54)(H,48,57)/t24-,30-,31-,32-,33-,34-/m0/s1
InChiKey: QDLOOBMEIDJZBQ-CXEROONLSA-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
Brugia malayi	Cathepsin L-like precursor	0.0358	1	1
Giardia lamblia	Cathepsin B precursor	0.0073	0.1759	0.3771
Giardia lamblia	Hypothetical protein	0.0073	0.1759	0.3771
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0073	0.1759	0.1759
Loa Loa (eye worm)	hypothetical protein	0.0242	0.6659	0.6476
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Trypanosoma cruzi	cysteine peptidase, putative	0.0358	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.51	0.48
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0073	0.1759	0.1569
Giardia lamblia	Cathepsin B precursor	0.0073	0.1759	0.3771
Schistosoma mansoni	cathepsin F (C01 family)	0.0242	0.6659	0.6562
Trypanosoma cruzi	Protein kinase B	0.0022	0.0283	0.0059
Brugia malayi	cathepsin L-like cysteine proteinase	0.0073	0.1759	0.1307
Entamoeba histolytica	cysteine proteinase 1, putative	0.0189	0.51	0.4987
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0073	0.1759	0.1569
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Plasmodium falciparum	serine repeat antigen 6	0.0073	0.1759	0.1569
Giardia lamblia	Cysteine protease	0.0073	0.1759	0.3771
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0073	0.1759	0.1569
Brugia malayi	Cathepsin L-like precursor	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Brugia malayi	Cathepsin L-like precursor	0.0242	0.6659	0.6476
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Entamoeba histolytica	cysteine proteinase, putative	0.0358	1	1
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0073	0.1759	0.3771
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.51	0.4987
Brugia malayi	Cathepsin L-like precursor	0.0115	0.2982	0.2597
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Loa Loa (eye worm)	hypothetical protein	0.0242	0.6659	0.6476
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Entamoeba histolytica	cysteine protease, putative	0.0358	1	1
Loa Loa (eye worm)	hypothetical protein	0.0115	0.2982	0.2597
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0242	0.6659	0.6582
Trichomonas vaginalis	conserved hypothetical protein	0.0073	0.1759	0.1759
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0073	0.1759	0.1519
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0073	0.1759	0.1307
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0022	0.0283	0.0059
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0073	0.1759	0.1519
Onchocerca volvulus		0.0358	1	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0115	0.2982	0.282
Trypanosoma cruzi	cysteine peptidase, putative	0.0115	0.2982	0.282
Loa Loa (eye worm)	hypothetical protein	0.0115	0.2982	0.2597
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Brugia malayi	Papain family cysteine protease containing protein	0.0358	1	1
Echinococcus multilocularis	cathepsin b	0.0356	0.9954	0.9953
Brugia malayi	cathepsin F-like cysteine proteinase	0.0115	0.2982	0.2597
Giardia lamblia	Cathepsin L-like protease	0.0073	0.1759	0.3771
Giardia lamblia	Cathepsin B precursor	0.0161	0.4294	1
Schistosoma mansoni	cathepsin s	0.0115	0.2982	0.2777
Plasmodium vivax	serine-repeat antigen (SERA)	0.0073	0.1759	0.1569
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Echinococcus multilocularis	cathepsin L	0.0189	0.51	0.4991
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0073	0.1759	0.1519
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0358	1	1
Leishmania major	cathepsin L-like protease	0.0358	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0358	1	1
Echinococcus multilocularis	cysteine protease	0.0358	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0073	0.1759	0.1759
Entamoeba histolytica	cysteine proteinase, putative	0.0358	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Brugia malayi	Cathepsin L-like precursor	0.0242	0.6659	0.6476
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0073	0.1759	0.1759
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0073	0.1759	0.3771
Trypanosoma cruzi	cysteine proteinase, putative	0.0189	0.51	0.4987
Loa Loa (eye worm)	cathepsin B	0.0161	0.4294	0.3981
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Giardia lamblia	Cysteine protease	0.0073	0.1759	0.3771
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0356	0.9954	0.9953
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0242	0.6659	0.6659
Echinococcus multilocularis	cysteine protease	0.0358	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0073	0.1759	0.1307
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0073	0.1759	0.1569
Onchocerca volvulus	Cathepsin L homolog	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Echinococcus granulosus	serine threonine protein kinase nrc	0.002	0.0225	0.0007
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0073	0.1759	0.1569
Echinococcus granulosus	serine/threonine protein kinase	0.0022	0.0283	0.0066
Giardia lamblia	Cathepsin B precursor	0.0161	0.4294	1
Toxoplasma gondii	cathepsin CPC1	0.0073	0.1759	0.1307
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0358	1	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0189	0.51	0.4987
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0073	0.1759	0.1307
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0073	0.1759	0.1307
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0189	0.51	0.4987
Trypanosoma cruzi	cysteine peptidase, putative	0.0358	1	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0356	0.9954	0.9953
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Loa Loa (eye worm)	hypothetical protein	0.0356	0.9954	0.9952
Echinococcus granulosus	cathepsin l1	0.0358	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0073	0.1759	0.1307
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0115	0.2982	0.2597
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0161	0.4294	0.4162
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0073	0.1759	0.1569
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0073	0.1759	0.1569
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0189	0.51	0.4957
Trypanosoma cruzi	cruzipain precursor, putative	0.0358	1	1
Plasmodium vivax	unspecified product	0.0115	0.2982	0.282
Giardia lamblia	Cathepsin B precursor	0.0073	0.1759	0.3771
Plasmodium falciparum	serine repeat antigen 8	0.0073	0.1759	0.1569
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0358	1	1
Plasmodium falciparum	serine repeat antigen 7	0.0073	0.1759	0.1569
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0022	0.0283	0.0059
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0358	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0356	0.9954	0.9953
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0358	1	1
Onchocerca volvulus		0.0358	1	1
Schistosoma mansoni	cathepsin B (C01 family)	0.0073	0.1759	0.1519
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0358	1	1
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0073	0.1759	0.1569
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0358	1	1
Leishmania major	cathepsin L-like protease	0.0358	1	1
Plasmodium falciparum	serine repeat antigen 3	0.0073	0.1759	0.1569
Echinococcus granulosus	cysteine protease	0.0189	0.51	0.4991
Echinococcus multilocularis	cathepsin L cysteine protease	0.0358	1	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0073	0.1759	0.3771
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0073	0.1759	0.1569
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0242	0.6659	0.6476
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0073	0.1759	0.1569
Brugia malayi	Papain family cysteine protease containing protein	0.0073	0.1759	0.1307
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Plasmodium vivax	vivapain-2	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0161	0.4294	0.4128
Echinococcus multilocularis	cathepsin L cysteine protease	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0073	0.1759	0.1759
Plasmodium falciparum	serine repeat antigen 1	0.0073	0.1759	0.1569
Toxoplasma gondii	cathepsin B	0.0161	0.4294	0.3981
Trypanosoma cruzi	cysteine peptidase, putative	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0073	0.1759	0.1759
Echinococcus granulosus	cathepsin b	0.0356	0.9954	0.9953
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0189	0.51	0.4957
Giardia lamblia	Cysteine protease	0.0073	0.1759	0.3771
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0189	0.51	0.4987
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0161	0.4294	0.4294
Giardia lamblia	Encystation-specific protease	0.0073	0.1759	0.3771
Trypanosoma cruzi	major cysteine proteinase, putative	0.0073	0.1759	0.1569
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0358	1	1
Brugia malayi	Cathepsin L-like precursor	0.0358	1	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0073	0.1759	0.1519
Leishmania major	cathepsin L-like protease	0.0358	1	1
Brugia malayi	fibroinase precursor	0.0073	0.1759	0.1307
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.51	0.4987
Entamoeba histolytica	protein kinase, putative	0.003	0.052	0.0302
Brugia malayi	cathepsin L-like precursor	0.0242	0.6659	0.6476
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0073	0.1759	0.1569
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.002	0.0225	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Echinococcus granulosus	cathepsin L	0.0189	0.51	0.4991
Plasmodium vivax	vivapain-2	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0073	0.1759	0.1759
Plasmodium falciparum	serine repeat antigen 9	0.0073	0.1759	0.1569
Leishmania major	cathepsin L-like protease	0.0358	1	1
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Entamoeba histolytica	cysteine protease, putative	0.0189	0.51	0.4987
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0073	0.1759	0.1569
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0242	0.6659	0.6659
Trypanosoma cruzi	cysteine protease, putative	0.0189	0.51	0.4987
Echinococcus granulosus	cathepsin L	0.0073	0.1759	0.1575
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0356	0.9954	0.9953
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0073	0.1759	0.1519
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Echinococcus multilocularis	rac serine:threonine kinase	0.0022	0.0283	0.0066
Onchocerca volvulus	Cathepsin F homolog	0.0358	1	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0189	0.51	0.4991
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Plasmodium vivax	unspecified product	0.0073	0.1759	0.1569
Onchocerca volvulus		0.0358	1	1
Echinococcus granulosus	cathepsin l1	0.0242	0.6659	0.6584
Leishmania major	cathepsin L-like protease	0.0358	1	1
Plasmodium vivax	serine-repeat antigen (SERA)	0.0073	0.1759	0.1569
Loa Loa (eye worm)	ctsf protein	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Loa Loa (eye worm)	hypothetical protein	0.0115	0.2982	0.2597
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Plasmodium vivax	vivapain-3	0.0189	0.51	0.4987
Trypanosoma cruzi	cysteine proteinase, putative	0.0189	0.51	0.4987
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0073	0.1759	0.1519
Onchocerca volvulus		0.0358	1	1
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0032	0.0578	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Loa Loa (eye worm)	hypothetical protein	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Giardia lamblia	Cathepsin B precursor	0.0161	0.4294	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0073	0.1759	0.1759
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Plasmodium falciparum	serine repeat antigen 2	0.0073	0.1759	0.1569
Schistosoma mansoni	cathepsin F (C01 family)	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0073	0.1759	0.1759
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0161	0.4294	0.3944
Entamoeba histolytica	cysteine protease, putative	0.0073	0.1759	0.1569
Giardia lamblia	Cysteine protease	0.0073	0.1759	0.3771
Entamoeba histolytica	hypothetical protein	0.0073	0.1759	0.1569
Trypanosoma cruzi	cysteine peptidase, putative	0.0358	1	1
Schistosoma mansoni	cathepsin C	0.0073	0.1759	0.1519
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1759	0.1307
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0189	0.51	0.4831
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Onchocerca volvulus		0.0242	0.6659	0.5946
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0073	0.1759	0.1519
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0073	0.1759	0.1759
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Leishmania major	cathepsin L-like protease	0.0358	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0115	0.2982	0.2597
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0189	0.51	0.48
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0358	1	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0073	0.1759	0.3771
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0073	0.1759	0.1569
Onchocerca volvulus		0.0358	1	1
Loa Loa (eye worm)	hypothetical protein	0.0242	0.6659	0.6476
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0073	0.1759	0.1519
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.51	0.51
Echinococcus granulosus	cathepsin b	0.0356	0.9954	0.9953
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0073	0.1759	0.1759
Entamoeba histolytica	cysteine proteinase 2	0.0189	0.51	0.4987
Plasmodium falciparum	serine repeat antigen 5	0.0073	0.1759	0.1569
Brugia malayi	cathepsin B-like cysteine proteinase	0.0356	0.9954	0.9952
Plasmodium vivax	unspecified product	0.0189	0.51	0.4987
Toxoplasma gondii	cathepsin CPC2	0.0073	0.1759	0.1307
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0073	0.1759	0.1569
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0022	0.0283	0.0059
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0073	0.1759	0.1759
Giardia lamblia	Cathepsin L-like protease	0.0073	0.1759	0.3771
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0073	0.1759	0.1307
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.002	0.0225	0.0007
Echinococcus multilocularis	cathepsin b	0.0356	0.9954	0.9953
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Plasmodium vivax	vivapain-1	0.0189	0.51	0.4987
Brugia malayi	Papain family cysteine protease containing protein	0.0189	0.51	0.4831
Toxoplasma gondii	cathepsin CPL	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Giardia lamblia	Cathepsin L precursor	0.0073	0.1759	0.3771
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0073	0.1759	0.1759
Giardia lamblia	Cathepsin B precursor	0.0073	0.1759	0.3771
Brugia malayi	cathepsin F-like cysteine proteinase	0.0073	0.1759	0.1307
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0356	0.9954	0.9953
Leishmania major	cathepsin L-like protease	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0073	0.1759	0.1307
Onchocerca volvulus		0.0358	1	1
Entamoeba histolytica	protein kinase, putative	0.0032	0.0578	0.0361
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0578	0.0578
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0358	1	1
Onchocerca volvulus		0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0073	0.1759	0.1307
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0189	0.51	0.51
Loa Loa (eye worm)	cysteine protease	0.0358	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.51	0.4987
Giardia lamblia	Cathepsin B precursor	0.0073	0.1759	0.3771
Entamoeba histolytica	cysteine proteinase, putative	0.0242	0.6659	0.6582
Plasmodium falciparum	serine repeat antigen 4	0.0073	0.1759	0.1569
Entamoeba histolytica	protein kinase, putative	0.0032	0.0578	0.0361
Entamoeba histolytica	cysteine proteinase, putative	0.0189	0.51	0.4987
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0073	0.1759	0.1759
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0073	0.1759	0.1519
Schistosoma mansoni	cathepsin S (C01 family)	0.0073	0.1759	0.1519
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0073	0.1759	0.1569
Brugia malayi	Cathepsin L-like precursor	0.0358	1	1
Brugia malayi	Protein kinase domain containing protein	0.0032	0.0578	0.0061
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0358	1	1
Giardia lamblia	Hypothetical protein	0.0073	0.1759	0.3771
Loa Loa (eye worm)	fibroinase	0.0358	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0358	1	1
Onchocerca volvulus	Cathepsin L homolog	0.0358	1	1
Brugia malayi	cathepsin L precursor	0.0073	0.1759	0.1307
Echinococcus multilocularis	cathepsin L	0.0073	0.1759	0.1575
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0189	0.51	0.4957
Trypanosoma cruzi	major cysteine proteinase, putative	0.0073	0.1759	0.1569
Leishmania major	cathepsin L-like protease	0.0358	1	1
Leishmania major	cysteine peptidase A (CPA)	0.0358	1	1
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0073	0.1759	0.1307
Brugia malayi	Cathepsin L-like precursor	0.0358	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
ED50 (functional)	= 0.00006 M kg-1	Analgesic activity in mice by using hot plate method	ChEMBL.	6312044
ED50 (functional)	= 0.00006 M kg-1	Analgesic activity in mice by using hot plate method	ChEMBL.	6312044
Relative potency (functional)	= 40.5	Inhibition of electrically evoked twitches in guinea pig ileum relative to morphine.	ChEMBL.	6312044

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: CHEMBL417677

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 45869