TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 434.531 | Formula: C25H30N4O3
H donors: 2 H acceptors: 2 LogP: 4.82 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CN(CCNc1c2C(=O)c3ccccc3C(=O)c2c(c2c1oc(c2)C)NCCN(C)C)C
InChi: 1S/C25H30N4O3/c1-15-14-18-21(26-10-12-28(2)3)19-20(22(25(18)32-15)27-11-13-29(4)5)24(31)17-9-7-6-8-16(17)23(19)30/h6-9,14,26-27H,10-13H2,1-5H3
InChiKey: CKWASGQMRNVGEM-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0054	0.0388	0.0497
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Echinococcus multilocularis	cathepsin L cysteine protease	0.0238	0.4785	0.4711
Echinococcus granulosus	semaphorin 5B	0.0059	0.0497	0.0497
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0057	0.0449	0.0314
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0057	0.0449	0.0449
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0164	0.3003	0.272
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0053	0.0361	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0075	0.0879	0.0879
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Loa Loa (eye worm)	fibroinase	0.0238	0.4785	0.4785
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0603	0.0603
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0075	0.0879	0.0879
Echinococcus multilocularis	hypothetical protein	0.0059	0.0497	0.0364
Schistosoma mansoni	cell adhesion molecule	0.0053	0.0361	0.0225
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Echinococcus granulosus	cathepsin l1	0.0238	0.4785	0.4785
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0054	0.0388	0.0253
Loa Loa (eye worm)	hypothetical protein	0.0082	0.1048	0.1048
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0054	0.0388	0.0497
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0053	0.0361	0.0225
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Echinococcus granulosus	tyrosine protein kinase ABL1	0.0453	0.9911	0.9911
Echinococcus granulosus	semaphorin 1A	0.0059	0.0497	0.0497
Echinococcus granulosus	cathepsin l1	0.0164	0.3003	0.3003
Echinococcus granulosus	neuroglian	0.0053	0.0361	0.0361
Schistosoma mansoni	cell adhesion molecule	0.0053	0.0361	0.0225
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0075	0.0879	0.075
Brugia malayi	hypothetical protein	0.0059	0.0497	0.0364
Schistosoma mansoni	plexin	0.0082	0.1048	0.0922
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0164	0.3003	0.5946
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Onchocerca volvulus	Cathepsin L homolog	0.0054	0.0388	0.0537
Schistosoma mansoni	cathepsin F (C01 family)	0.0238	0.4785	0.4711
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Onchocerca volvulus		0.0054	0.0388	0.0537
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0053	0.0361	0.0225
Echinococcus granulosus	nephrin	0.0044	0.0139	0.0139
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Brugia malayi	Sema domain containing protein	0.0059	0.0497	0.0364
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0053	0.0361	0.0225
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0218	0.0218
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Echinococcus multilocularis	cathepsin L	0.0129	0.2171	0.2061
Loa Loa (eye worm)	CAMK protein kinase	0.0044	0.0139	0.0139
Schistosoma mansoni	ephrin receptor	0.0053	0.037	0.0234
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Echinococcus multilocularis	cysteine protease	0.0238	0.4785	0.4711
Echinococcus multilocularis	roundabout 2	0.0053	0.0361	0.0225
Echinococcus granulosus	cathepsin L	0.0054	0.0388	0.0388
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Echinococcus granulosus	Down syndrome cell adhesion molecule	0.0044	0.0143	0.0143
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0179	0.3361	0.6762
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0195	0.3746	0.3658
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0238	0.4785	0.4711
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0053	0.0361	0.0225
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0054	0.0388	0.0253
Trypanosoma cruzi	cruzipain precursor, putative	0.0238	0.4785	0.4574
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0139	0.0139
Echinococcus granulosus	titin	0.0044	0.0139	0.0139
Onchocerca volvulus		0.0238	0.4785	1
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0054	0.0388	0.0253
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0044	0.0139	0.0139
Entamoeba histolytica	cysteine proteinase, putative	0.0129	0.2171	0.4349
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0453	0.9911	0.9909
Trypanosoma cruzi	cysteine peptidase, putative	0.0238	0.4785	0.4574
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Schistosoma mansoni	nephrin	0.0053	0.0361	0.0225
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3003	0.3003
Onchocerca volvulus		0.0238	0.4785	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0179	0.3361	0.3093
Echinococcus multilocularis	neuroglian	0.0053	0.0361	0.0225
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Onchocerca volvulus		0.0238	0.4785	1
Echinococcus multilocularis	cysteine protease	0.0238	0.4785	0.4711
Plasmodium vivax	vivapain-1	0.0129	0.2171	0.4054
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0053	0.0361	0.0361
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0054	0.0388	0.0253
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0238	0.4785	1
Schistosoma mansoni	cathepsin S (C01 family)	0.0054	0.0388	0.0253
Brugia malayi	cathepsin F-like cysteine proteinase	0.0054	0.0388	0.0253
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0054	0.0388	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3003	0.3003
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0238	0.4785	0.4711
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0179	0.3361	0.4554
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Plasmodium vivax	unspecified product	0.0129	0.2171	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Entamoeba histolytica	cysteine proteinase, putative	0.0238	0.4785	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0053	0.0361	0.0225
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Schistosoma mansoni	cell adhesion molecule	0.0072	0.0825	0.0696
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0238	0.4785	1
Giardia lamblia	Cathepsin B precursor	0.0179	0.3361	1
Schistosoma mansoni	semaphorin 5-related	0.0059	0.0497	0.0364
Onchocerca volvulus		0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Entamoeba histolytica	cysteine proteinase, putative	0.0129	0.2171	0.4349
Entamoeba histolytica	cysteine protease, putative	0.0238	0.4785	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0238	0.4785	0.4711
Brugia malayi	hypothetical protein	0.0059	0.0497	0.0364
Brugia malayi	Papain family cysteine protease containing protein	0.0054	0.0388	0.0253
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0238	0.4785	1
Echinococcus granulosus	roundabout 2	0.0053	0.0361	0.0361
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Plasmodium vivax	vivapain-3	0.0129	0.2171	0.4054
Echinococcus multilocularis	semaphorin 5B	0.0059	0.0497	0.0364
Brugia malayi	cathepsin L-like precursor	0.0164	0.3003	0.2904
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.0388	0.0253
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Onchocerca volvulus	Cathepsin F homolog	0.0238	0.4785	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0075	0.0879	0.075
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0129	0.2171	0.2061
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0179	0.3361	0.3268
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0053	0.037	0.037
Entamoeba histolytica	cysteine proteinase, putative	0.0129	0.2171	0.4349
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0054	0.0388	0.0253
Schistosoma mansoni	cathepsin B (C01 family)	0.0054	0.0388	0.0253
Echinococcus multilocularis	contactin neuroglian septate junction protein	0.0053	0.0361	0.0225
Schistosoma mansoni	cathepsin F (C01 family)	0.0164	0.3003	0.2904
Loa Loa (eye worm)	hypothetical protein	0.0238	0.4785	0.4785
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0164	0.3003	0.5946
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0139	0.0139
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Brugia malayi	Cathepsin L-like precursor	0.0075	0.0879	0.075
Echinococcus granulosus	plexin a4	0.0166	0.3063	0.3063
Echinococcus granulosus	roundabout 2	0.0081	0.1042	0.1042
Brugia malayi	cathepsin L precursor	0.0054	0.0388	0.0253
Brugia malayi	Cathepsin L-like precursor	0.0164	0.3003	0.2904
Trypanosoma cruzi	cysteine peptidase, putative	0.0238	0.4785	0.4574
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0044	0.0143	0.0143
Loa Loa (eye worm)	sema domain-containing protein	0.0059	0.0497	0.0497
Schistosoma mansoni	hypothetical protein	0.0082	0.1048	0.0922
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Schistosoma mansoni	nephrin	0.0072	0.082	0.0691
Entamoeba histolytica	cysteine proteinase, putative	0.0129	0.2171	0.4349
Loa Loa (eye worm)	ctsf protein	0.0238	0.4785	0.4785
Schistosoma mansoni	hypothetical protein	0.0059	0.0497	0.0364
Loa Loa (eye worm)	sema domain-containing protein	0.0059	0.0497	0.0497
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Brugia malayi	Sema domain containing protein	0.0059	0.0497	0.0364
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0238	0.4785	1
Entamoeba histolytica	cysteine proteinase, putative	0.0164	0.3003	0.6147
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Loa Loa (eye worm)	hypothetical protein	0.0182	0.3451	0.3451
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0238	0.4785	0.4785
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0497	0.0497
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0603	0.0603
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Brugia malayi	Tyrosine-protein kinase abl-1	0.0264	0.5407	0.5342
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0054	0.0388	0.0388
Echinococcus granulosus	cathepsin L	0.0129	0.2171	0.2171
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Plasmodium vivax	vivapain-2	0.0238	0.4785	1
Onchocerca volvulus		0.0164	0.3003	0.6164
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0218	0.0218
Trypanosoma cruzi	cysteine proteinase, putative	0.0129	0.2171	0.1854
Onchocerca volvulus		0.014	0.2449	0.4973
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.0388	0.0253
Plasmodium vivax	vivapain-2	0.0238	0.4785	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0238	0.4785	0.4785
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Brugia malayi	Tyrosine-protein kinase abl-1	0.0195	0.3746	0.3658
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0053	0.037	0.0234
Echinococcus granulosus	cysteine protease	0.0129	0.2171	0.2171
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0053	0.0361	0.0225
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0053	0.0361	0.0361
Loa Loa (eye worm)	projectin	0.0044	0.0139	0.0139
Brugia malayi	Fibronectin type III domain containing protein	0.0063	0.0603	0.0471
Brugia malayi	Papain family cysteine protease containing protein	0.0129	0.2171	0.2061
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0129	0.2171	0.2061
Loa Loa (eye worm)	hypothetical protein	0.0075	0.0879	0.0879
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0129	0.2171	0.4054
Schistosoma mansoni	plexin	0.014	0.2449	0.2343
Schistosoma mansoni	hypothetical protein	0.0059	0.0497	0.0364
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0164	0.3003	0.2904
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Onchocerca volvulus		0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Schistosoma mansoni	cathepsin s	0.0075	0.0879	0.075
Brugia malayi	Papain family cysteine protease containing protein	0.0054	0.0388	0.0253
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0129	0.2171	0.4054
Leishmania major	cysteine peptidase A (CPA)	0.0238	0.4785	1
Echinococcus granulosus	contactin	0.0053	0.0361	0.0361
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Onchocerca volvulus		0.0238	0.4785	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0129	0.2171	0.1854
Trypanosoma cruzi	cysteine peptidase, putative	0.0075	0.0879	0.051
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0129	0.2171	0.1854
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0044	0.0139	0.0139
Onchocerca volvulus	Cathepsin L homolog	0.0238	0.4785	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Schistosoma mansoni	cathepsin F (C01 family)	0.0238	0.4785	0.4711
Brugia malayi	hypothetical protein	0.0063	0.0603	0.0471
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0053	0.0361	0.0225
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Loa Loa (eye worm)	TK/ABL protein kinase	0.0453	0.9911	0.9911
Entamoeba histolytica	cysteine proteinase, putative	0.0238	0.4785	1
Brugia malayi	Papain family cysteine protease containing protein	0.0054	0.0388	0.0253
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0388	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0075	0.0879	0.0879
Echinococcus granulosus	titin	0.0044	0.0139	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0603	0.0603
Toxoplasma gondii	cathepsin CPL	0.0238	0.4785	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0054	0.0388	0.0253
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0129	0.2171	0.4054
Onchocerca volvulus	Cathepsin L homolog	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Brugia malayi	Papain family cysteine protease containing protein	0.0238	0.4785	0.4711
Trypanosoma cruzi	cruzipain precursor, putative	0.0075	0.0879	0.051
Toxoplasma gondii	cathepsin B	0.0179	0.3361	0.6762
Echinococcus multilocularis	Down syndrome cell adhesion molecule	0.0044	0.0143	0.0005
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0044	0.0143	0.0005
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0054	0.0388	0.0253
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0238	0.4785	1
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0054	0.0388	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0361	0.0361
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Echinococcus granulosus	roundabout 2	0.0053	0.0361	0.0361
Entamoeba histolytica	cysteine proteinase 2	0.0129	0.2171	0.4349
Brugia malayi	Cathepsin L-like precursor	0.0238	0.4785	0.4711
Entamoeba histolytica	hypothetical protein	0.0054	0.0388	0.0497
Schistosoma mansoni	cathepsin C	0.0054	0.0388	0.0253
Trypanosoma cruzi	cysteine proteinase, putative	0.0129	0.2171	0.1854
Schistosoma mansoni	tyrosine kinase	0.0447	0.9761	0.9758
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.0388	0.0253
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3003	0.3003
Echinococcus multilocularis	cathepsin L	0.0054	0.0388	0.0253
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0044	0.0139	0.0139
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0054	0.0388	0.0253
Brugia malayi	Plexin repeat family protein	0.014	0.2449	0.2343
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0044	0.0139	0.0139
Schistosoma mansoni	neuroglian	0.0053	0.0361	0.0225
Loa Loa (eye worm)	cathepsin B	0.0179	0.3361	0.3361
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0129	0.2171	0.2061
Echinococcus granulosus	cathepsin L cysteine protease	0.0129	0.2171	0.2171
Trypanosoma cruzi	cysteine peptidase, putative	0.0238	0.4785	0.4574
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0238	0.4785	0.4574
Giardia lamblia	Cathepsin B precursor	0.0179	0.3361	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Entamoeba histolytica	cysteine protease, putative	0.0129	0.2171	0.4349
Brugia malayi	fibroinase precursor	0.0054	0.0388	0.0253
Brugia malayi	plexin A	0.0166	0.3063	0.2965
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0044	0.0139	0.0139
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0238	0.4785	1
Giardia lamblia	Cathepsin B precursor	0.0179	0.3361	1
Echinococcus multilocularis	roundabout 2	0.0081	0.1042	0.0916
Onchocerca volvulus		0.0238	0.4785	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Loa Loa (eye worm)	hypothetical protein	0.014	0.2449	0.2449
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.0388	0.0253
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0238	0.4785	0.4785
Brugia malayi	Papain family cysteine protease containing protein	0.0129	0.2171	0.2061
Entamoeba histolytica	cysteine proteinase 1, putative	0.0129	0.2171	0.4349
Onchocerca volvulus		0.0059	0.0497	0.0772
Loa Loa (eye worm)	plexin A	0.0166	0.3063	0.3063
Trypanosoma cruzi	cysteine protease, putative	0.0129	0.2171	0.1854
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0063	0.0603	0.0471
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0238	0.4785	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0238	0.4785	1
Echinococcus multilocularis	roundabout 2	0.0053	0.0361	0.0225
Loa Loa (eye worm)	cysteine protease	0.0238	0.4785	0.4785
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0238	0.4785	0.4785
Plasmodium vivax	unspecified product	0.0075	0.0879	0.1115
Brugia malayi	Cathepsin L-like precursor	0.0164	0.3003	0.2904
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0388	0.0497
Echinococcus multilocularis	plexin a4	0.0166	0.3063	0.2965
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0054	0.0388	0.0253
Leishmania major	cathepsin L-like protease	0.0238	0.4785	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.44 uM	Cytotoxicity against human CEM cells after 72 hrs by MTT assay	ChEMBL.	21144624
IC50 (functional)	= 0.51 uM	Cytotoxicity against mouse L1210 cells after 48 hrs by MTT assay	ChEMBL.	21144624
IC50 (functional)	= 0.6 uM	Cytotoxicity against human K562 cells after 72 hrs by MTT assay	ChEMBL.	21144624
IC50 (functional)	= 2.6 uM	Cytotoxicity against human p53 knockout HCT116 cells after 72 hrs by MTT assay	ChEMBL.	21144624
IC50 (functional)	= 7.5 uM	Cytotoxicity against human HCT116 cells after 72 hrs by MTT assay	ChEMBL.	21144624

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	21144624
Mus musculus	ChEMBL23	21144624

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: CHEMBL1652384

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1507705