TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 593.553 | Formula: C21H22F3N5O8S2
H donors: 5 H acceptors: 7 LogP: 1.28 Rotable bonds: 12
Rule of 5 violations (Lipinski): 2
SMILES: OC(=O)C(F)(F)F.O=C(CC1ON=C(C1)c1ccc(cc1)C(=N)N)NC[C@@H](C(=O)O)NS(=O)(=O)c1cccs1
InChi: 1S/C19H21N5O6S2.C2HF3O2/c20-18(21)12-5-3-11(4-6-12)14-8-13(30-23-14)9-16(25)22-10-15(19(26)27)24-32(28,29)17-2-1-7-31-17;3-2(4,5)1(6)7/h1-7,13,15,24H,8-10H2,(H3,20,21)(H,22,25)(H,26,27);(H,6,7)/t13?,15-;/m0./s1
InChiKey: DMXUBNIPPYNVGB-LDCKTULKSA-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
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0265	0.6614	0.6562
Schistosoma mansoni	cpg binding protein	0.0056	0.124	0.124
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0052	0.1143	0.1574
Schistosoma mansoni	cathepsin F (C01 family)	0.0179	0.4396	0.4396
Brugia malayi	CXXC zinc finger family protein	0.0056	0.124	0.1576
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0052	0.1143	0.1416
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0138	0.3361	0.3361
Toxoplasma gondii	cathepsin CPC2	0.0052	0.1143	0.0726
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Entamoeba histolytica	cysteine proteinase, putative	0.0265	0.6614	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0956	0.0956
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0096	0.2262	0.3297
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0052	0.1143	0.0726
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Entamoeba histolytica	cysteine proteinase, putative	0.0138	0.3361	0.4486
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0052	0.1143	0.1416
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0052	0.1143	0.1574
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0014	0.0152	0.0152
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0052	0.1143	0.1574
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0193	0.4761	0.4761
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	cysteine proteinase, putative	0.0138	0.3361	0.4486
Trypanosoma cruzi	major cysteine proteinase, putative	0.0052	0.1143	0.0726
Plasmodium vivax	unspecified product	0.0086	0.2011	0.1587
Schistosoma mansoni	cpg binding protein	0.0059	0.1322	0.1322
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0714	0.0914
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Echinococcus granulosus	cathepsin L	0.0138	0.3361	0.3258
Onchocerca volvulus		0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0052	0.1143	0.0726
Loa Loa (eye worm)	hypothetical protein	0.0179	0.4396	0.652
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0106	0.2534	0.3085
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0714	0.0914
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Loa Loa (eye worm)	cathepsin B	0.0096	0.2262	0.3171
Echinococcus granulosus	cathepsin L cysteine protease	0.0138	0.3361	0.3258
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0138	0.3361	0.499
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0052	0.1143	0.1423
Echinococcus multilocularis	cysteine protease	0.0265	0.6614	0.6562
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Toxoplasma gondii	cathepsin CPL	0.0265	0.6614	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0056	0.124	0.1568
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0032	0.0618	0.5
Trypanosoma cruzi	cysteine protease, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0265	0.6614	1
Loa Loa (eye worm)	cysteine protease	0.0265	0.6614	1
Entamoeba histolytica	cysteine proteinase, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0052	0.1143	0.0726
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0193	0.4761	0.6858
Loa Loa (eye worm)	ctsf protein	0.0265	0.6614	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0179	0.4396	0.624
Trypanosoma cruzi	cysteine peptidase, putative	0.0086	0.2011	0.2197
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0714	0.0714
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Onchocerca volvulus		0.0265	0.6614	1
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Loa Loa (eye worm)	hypothetical protein	0.0179	0.4396	0.652
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Plasmodium vivax	vivapain-2	0.0265	0.6614	1
Schistosoma mansoni	cathepsin B (C01 family)	0.0052	0.1143	0.1143
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Brugia malayi	Inositol-1	0.0036	0.0714	0.0752
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Onchocerca volvulus		0.0265	0.6614	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0052	0.1143	0.1423
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0138	0.3361	0.3361
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0956	0.0816
Loa Loa (eye worm)	hypothetical protein	0.0265	0.6614	1
Echinococcus granulosus	cysteine protease	0.0138	0.3361	0.3258
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0265	0.6614	0.6562
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0119	0.2862	0.2862
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0179	0.4396	0.6584
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0017	0.024	0.009
Giardia lamblia	Cathepsin B precursor	0.0096	0.2262	1
Plasmodium vivax	unspecified product	0.0138	0.3361	0.4054
Echinococcus multilocularis	cpg binding protein	0.0059	0.1322	0.1188
Brugia malayi	Papain family cysteine protease containing protein	0.0052	0.1143	0.1423
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0956	0.0816
Loa Loa (eye worm)	hypothetical protein	0.0086	0.2011	0.2778
Schistosoma mansoni	cathepsin s	0.0086	0.2011	0.2011
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Brugia malayi	Cathepsin L-like precursor	0.0179	0.4396	0.6523
Trypanosoma cruzi	cysteine peptidase, putative	0.0265	0.6614	1
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Entamoeba histolytica	cysteine proteinase, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Echinococcus granulosus	cathepsin l1	0.0179	0.4396	0.431
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0179	0.4396	0.6523
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Toxoplasma gondii	cathepsin CPC1	0.0052	0.1143	0.0726
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0052	0.1143	0.1423
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0714	0.5
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0714	0.0571
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0052	0.1143	0.1143
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0956	0.0956
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Trypanosoma cruzi	major cysteine proteinase, putative	0.0052	0.1143	0.0726
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0052	0.1143	0.1574
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0052	0.1143	0.1574
Brugia malayi	Papain family cysteine protease containing protein	0.0265	0.6614	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	0.4761	0.4761
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0138	0.3361	0.4054
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0956	0.0816
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0052	0.1143	0.1143
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0052	0.1143	0.1143
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0096	0.2262	0.2623
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Echinococcus granulosus	cathepsin b	0.0193	0.4761	0.468
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	cysteine proteinase 2	0.0138	0.3361	0.4486
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0086	0.2011	0.2784
Brugia malayi	cathepsin L precursor	0.0052	0.1143	0.1423
Loa Loa (eye worm)	hypothetical protein	0.0179	0.4396	0.652
Onchocerca volvulus		0.0265	0.6614	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0956	0.1123
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0052	0.1143	0.1416
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0052	0.1143	0.1574
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0086	0.2011	0.2197
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0714	0.0714
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0956	0.0956
Brugia malayi	fibroinase precursor	0.0052	0.1143	0.1423
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0138	0.3361	0.499
Brugia malayi	Cathepsin L-like precursor	0.0179	0.4396	0.6523
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0052	0.1143	0.1143
Echinococcus multilocularis	cysteine protease	0.0265	0.6614	0.6562
Echinococcus granulosus	cathepsin L	0.0052	0.1143	0.1006
Echinococcus multilocularis	cathepsin b	0.0193	0.4761	0.468
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	0.4761	0.4761
Echinococcus granulosus	cathepsin b	0.0193	0.4761	0.468
Onchocerca volvulus	Cathepsin L homolog	0.0265	0.6614	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0714	0.0914
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0052	0.1143	0.1574
Onchocerca volvulus		0.0265	0.6614	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0956	0.0816
Schistosoma mansoni	cathepsin F (C01 family)	0.0265	0.6614	0.6614
Onchocerca volvulus		0.0056	0.124	0.0177
Leishmania major	cysteine peptidase A (CPA)	0.0265	0.6614	1
Plasmodium vivax	vivapain-2	0.0265	0.6614	1
Echinococcus multilocularis	cathepsin L	0.0138	0.3361	0.3258
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0265	0.6614	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Trypanosoma cruzi	cysteine proteinase, putative	0.0138	0.3361	0.4486
Brugia malayi	Papain family cysteine protease containing protein	0.0138	0.3361	0.49
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0052	0.1143	0.1143
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0265	0.6614	0.6562
Brugia malayi	Papain family cysteine protease containing protein	0.0052	0.1143	0.1423
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Brugia malayi	Cathepsin L-like precursor	0.0086	0.2011	0.2784
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0096	0.2262	0.2262
Schistosoma mansoni	cathepsin C	0.0052	0.1143	0.1143
Schistosoma mansoni	hypothetical protein	0.0396	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0265	0.6614	0.6562
Echinococcus multilocularis	dnaJ subfamily B	0.0396	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0052	0.1143	0.1143
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0138	0.3361	0.4486
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0138	0.3361	0.4486
Toxoplasma gondii	cathepsin B	0.0096	0.2262	0.2623
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0052	0.1143	0.1143
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0714	0.5
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0017	0.024	0.009
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Plasmodium vivax	vivapain-3	0.0138	0.3361	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.0138	0.3361	0.49
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0052	0.1143	0.1574
Brugia malayi	cathepsin L-like precursor	0.0179	0.4396	0.6523
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.1143	0.1574
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0138	0.3361	0.4486
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0265	0.6614	0.6562
Trypanosoma cruzi	cysteine proteinase, putative	0.0138	0.3361	0.4486
Loa Loa (eye worm)	inositol-1	0.0036	0.0714	0.0744
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0265	0.6614	0.6614
Brugia malayi	cathepsin B-like cysteine proteinase	0.0193	0.4761	0.7094
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0052	0.1143	0.1423
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0096	0.2262	0.2623
Onchocerca volvulus	Cathepsin L homolog	0.0265	0.6614	1
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0956	0.1131
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0265	0.6614	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0265	0.6614	1
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0052	0.1143	0.1143
Brugia malayi	cathepsin F-like cysteine proteinase	0.0086	0.2011	0.2784
Loa Loa (eye worm)	fibroinase	0.0265	0.6614	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0265	0.6614	1
Brugia malayi	Papain family cysteine protease containing protein	0.0052	0.1143	0.1423
Echinococcus granulosus	cathepsin l1	0.0265	0.6614	0.6562
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Giardia lamblia	Cathepsin B precursor	0.0096	0.2262	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574
Loa Loa (eye worm)	hypothetical protein	0.0086	0.2011	0.2778
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0179	0.4396	0.6584
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0052	0.1143	0.1574
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0052	0.1143	0.1574
Onchocerca volvulus		0.0265	0.6614	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0052	0.1143	0.1423
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.0714	0.0571
Entamoeba histolytica	cysteine proteinase 1, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	cysteine proteinase, putative	0.0179	0.4396	0.624
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574
Schistosoma mansoni	cpg binding protein	0.0059	0.1322	0.1322
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0265	0.6614	0.6562
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1143	0.1416
Onchocerca volvulus	Cathepsin F homolog	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Entamoeba histolytica	hypothetical protein	0.0052	0.1143	0.0726
Schistosoma mansoni	cathepsin S (C01 family)	0.0052	0.1143	0.1143
Giardia lamblia	Cathepsin B precursor	0.0096	0.2262	1
Onchocerca volvulus		0.0265	0.6614	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0052	0.1143	0.1143
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0265	0.6614	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0265	0.6614	1
Echinococcus multilocularis	cathepsin b	0.0193	0.4761	0.468
Echinococcus multilocularis	cathepsin L	0.0052	0.1143	0.1006
Trypanosoma cruzi	cysteine peptidase, putative	0.0138	0.3361	0.4486
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0265	0.6614	1
Loa Loa (eye worm)	hypothetical protein	0.0193	0.4761	0.7092
Trypanosoma cruzi	cysteine peptidase, putative	0.0265	0.6614	1
Entamoeba histolytica	cysteine proteinase, putative	0.0265	0.6614	1
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0052	0.1143	0.1574
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0265	0.6614	1
Onchocerca volvulus		0.0179	0.4396	0.5946
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.1143	0.1574
Brugia malayi	Cathepsin L-like precursor	0.0265	0.6614	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0086	0.2011	0.2778
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0138	0.3361	0.3361
Entamoeba histolytica	cysteine protease, putative	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0032	0.0618	0.5
Plasmodium vivax	vivapain-1	0.0138	0.3361	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0138	0.3361	0.4486
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0193	0.4761	0.4761
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0096	0.2262	0.2623
Echinococcus granulosus	cpg binding protein	0.0059	0.1322	0.1188
Loa Loa (eye worm)	hypothetical protein	0.0086	0.2011	0.2778
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0265	0.6614	1
Entamoeba histolytica	cysteine protease, putative	0.0052	0.1143	0.0726
Leishmania major	cathepsin L-like protease	0.0265	0.6614	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0052	0.1143	0.1574

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.024 uM	The compound was tested for their ability to inhibit ADP-stimulated platelet aggregation in human platelet rich plasma	ChEMBL.	10197962
IC50 (functional)	= 0.024 uM	The compound was tested for their ability to inhibit ADP-stimulated platelet aggregation in human platelet rich plasma	ChEMBL.	10197962

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	10197962

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 19795