TDR Targets

Basic information

Technical information

TDR Targets ID: 313397
Name: 1-quinolin-5-yl-3-[3-(trifluoromethylsulfanyl )phenyl]urea
MW: 363.357 | Formula: C17H12F3N3OS
H donors: 2 H acceptors: 2 LogP: 4.47 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1cccc2c1cccn2)Nc1cccc(c1)SC(F)(F)F
InChi: 1S/C17H12F3N3OS/c18-17(19,20)25-12-5-1-4-11(10-12)22-16(24)23-15-8-2-7-14-13(15)6-3-9-21-14/h1-10H,(H2,22,23,24)
InChiKey: OUBFHRCJKDOFHM-UHFFFAOYSA-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

1-(5-quinolyl)-3-[3-(trifluoromethylsulfanyl)phenyl]urea
1-(5-quinolyl)-3-[3-(trifluoromethylthio)phenyl]urea

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	transient receptor potential cation channel, subfamily V, member 1	Starlite/ChEMBL	References

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
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.0209	0.0687	0.5
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0484	0.2878	0.3259
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Giardia lamblia	Cathepsin B precursor	0.0453	0.2626	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0394	0.2163	0.2034
Echinococcus granulosus	cathepsin l1	0.0272	0.119	0.1045
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	0.3259
Trypanosoma cruzi	cysteine peptidase, putative	0.0394	0.2163	0.245
Trypanosoma brucei	calpain-like protein, putative	0.0484	0.2878	1
Onchocerca volvulus		0.0394	0.2163	0.294
Onchocerca volvulus	Cathepsin L homolog	0.0394	0.2163	0.294
Echinococcus granulosus	calpain 5	0.0484	0.2878	0.2761
Echinococcus multilocularis	cysteine protease	0.0394	0.2163	0.2034
Schistosoma mansoni	cathepsin F (C01 family)	0.0272	0.119	0.1193
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Trypanosoma brucei	calpain-like protein, putative	0.0484	0.2878	1
Brugia malayi	dihydrofolate reductase family protein	0.0209	0.0687	0.0743
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Echinococcus granulosus	caspase 2	0.0226	0.0821	0.067
Plasmodium vivax	vivapain-2	0.0394	0.2163	0.7515
Loa Loa (eye worm)	cysteine protease	0.0394	0.2163	0.2342
Toxoplasma gondii	cathepsin B	0.0453	0.2626	1
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Giardia lamblia	Cathepsin B precursor	0.0453	0.2626	0.5
Echinococcus multilocularis	caspase 3, apoptosis cysteine peptidase	0.0247	0.0991	0.0843
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Brugia malayi	calpain 5	0.0339	0.1721	0.1863
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1233	0.8831	0.8848
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0484	0.2878	0.3259
Loa Loa (eye worm)	hypothetical protein	0.0945	0.6543	0.7084
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Echinococcus multilocularis	calpain family protein 1, d	0.0945	0.6543	0.6486
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0272	0.119	0.4118
Brugia malayi	Cathepsin L-like precursor	0.0272	0.119	0.1289
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Brugia malayi	Papain family cysteine protease containing protein	0.0226	0.0821	0.0889
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1377	0.998	1
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.0209	0.0687	0.1863
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0453	0.2626	0.2631
Echinococcus granulosus	calpain A	0.0484	0.2878	0.2761
Loa Loa (eye worm)	calpain 5	0.0339	0.1721	0.1863
Plasmodium vivax	vivapain-1	0.0226	0.0821	0.2852
Echinococcus granulosus	caspase 3 apoptosis cysteine peptidase	0.0247	0.0991	0.0843
Leishmania major	kinesin, putative	0.0339	0.1721	0.5701
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.1377	0.998	0.998
Brugia malayi	Papain family cysteine protease containing protein	0.0226	0.0821	0.0889
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.0209	0.0687	0.5
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0226	0.0821	0.0823
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Entamoeba histolytica	cysteine proteinase 1, putative	0.0226	0.0821	0.3215
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0394	0.2163	0.8104
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Loa Loa (eye worm)	cathepsin B	0.0453	0.2626	0.2843
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.0209	0.0687	0.2386
Onchocerca volvulus	Cathepsin L homolog	0.0394	0.2163	0.294
Echinococcus granulosus	cathepsin L cysteine protease	0.0226	0.0821	0.0669
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0394	0.2163	1
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0272	0.119	0.1289
Leishmania major	cysteine peptidase A (CPA)	0.0394	0.2163	0.7345
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Brugia malayi	Papain family cysteine protease containing protein	0.0394	0.2163	0.2342
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0821	0.2605
Trypanosoma cruzi	cysteine peptidase, putative	0.0394	0.2163	0.245
Trypanosoma brucei	calpain-like protein, putative	0.0484	0.2878	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	cysteine proteinase, putative	0.0226	0.0821	0.093
Onchocerca volvulus		0.0394	0.2163	0.294
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0484	0.2878	0.3259
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0394	0.2163	0.2034
Trypanosoma cruzi	conserved protein	0.0146	0.0185	0.0209
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Loa Loa (eye worm)	hypothetical protein	0.0394	0.2163	0.2342
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0394	0.2163	0.2342
Echinococcus multilocularis	caspase	0.0247	0.0991	0.0843
Loa Loa (eye worm)	hypothetical protein	0.0272	0.119	0.1289
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1233	0.8831	0.8848
Echinococcus granulosus	cathepsin b	0.1233	0.8831	0.8811
Trypanosoma cruzi	cruzipain precursor, putative	0.0394	0.2163	0.245
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Chlamydia trachomatis	dihydrofolate reductase	0.0209	0.0687	0.5
Loa Loa (eye worm)	hypothetical protein	0.0272	0.119	0.1289
Schistosoma mansoni	calpain-7 (C02 family)	0.0484	0.2878	0.2884
Echinococcus multilocularis	calpain 7 (C02 family)	0.0484	0.2878	0.2761
Loa Loa (eye worm)	calpain D	0.0146	0.0185	0.02
Entamoeba histolytica	calpain large subunit domain III containing protein	0.0339	0.1721	0.7763
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Echinococcus granulosus	calpain	0.0484	0.2878	0.2761
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Echinococcus granulosus	cathepsin b	0.1233	0.8831	0.8811
Echinococcus granulosus	calpain 7 C02 family	0.0484	0.2878	0.2761
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Loa Loa (eye worm)	calpain family protein 1	0.0945	0.6543	0.7084
Onchocerca volvulus	Cathepsin F homolog	0.0394	0.2163	0.294
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0226	0.0821	0.2361
Echinococcus multilocularis	calpain 5	0.0484	0.2878	0.2761
Trypanosoma cruzi	kinesin, putative	0.0339	0.1721	0.1948
Trypanosoma cruzi	cysteine protease, putative	0.0226	0.0821	0.093
Echinococcus granulosus	cysteine protease	0.0226	0.0821	0.0669
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1233	0.8831	0.8848
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0226	0.0821	0.2605
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0226	0.0821	0.2361
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Echinococcus granulosus	caspase	0.0247	0.0991	0.0843
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0394	0.2163	1
Schistosoma mansoni	Mername-AA248 (C02 family)	0.0484	0.2878	0.2884
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0453	0.2626	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Loa Loa (eye worm)	calpain	0.0484	0.2878	0.3116
Onchocerca volvulus		0.0394	0.2163	0.294
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Plasmodium vivax	vivapain-3	0.0226	0.0821	0.2852
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0484	0.2878	0.3259
Schistosoma mansoni	caspase-3 (C14 family)	0.0247	0.0991	0.0993
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.0209	0.0687	0.2537
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.1377	0.998	0.998
Onchocerca volvulus		0.0799	0.5385	1
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Schistosoma mansoni	calpain (C02 family)	0.0484	0.2878	0.2884
Onchocerca volvulus		0.0272	0.119	0.0808
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0394	0.2163	0.2034
Echinococcus granulosus	dihydrofolate reductase	0.0209	0.0687	0.0533
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.0209	0.0687	0.2056
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0453	0.2626	0.9064
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Schistosoma mansoni	dihydrofolate reductase	0.0209	0.0687	0.0688
Leishmania major	calpain, putative,cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	1
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0484	0.2878	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	0.3259
Echinococcus multilocularis	caspase 2	0.0226	0.0821	0.067
Schistosoma mansoni	caspase-7 (C14 family)	0.0226	0.0821	0.0823
Trypanosoma cruzi	cysteine peptidase, putative	0.0394	0.2163	0.245
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Brugia malayi	calpain family protein 1	0.1284	0.9237	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0272	0.119	0.4118
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Brugia malayi	Cathepsin L-like precursor	0.0272	0.119	0.1289
Echinococcus granulosus	cathepsin L	0.0226	0.0821	0.0669
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Schistosoma mansoni	cathepsin F (C01 family)	0.0394	0.2163	0.2167
Echinococcus multilocularis	cysteine protease	0.0394	0.2163	0.2034
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.0209	0.0687	0.5
Echinococcus multilocularis	dihydrofolate reductase	0.0209	0.0687	0.0533
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Toxoplasma gondii	cathepsin CPL	0.0394	0.2163	0.8104
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Brugia malayi	calpain D	0.0146	0.0185	0.02
Onchocerca volvulus		0.0394	0.2163	0.294
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Entamoeba histolytica	cysteine proteinase, putative	0.0394	0.2163	1
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Plasmodium vivax	calpain, putative	0.0484	0.2878	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Echinococcus multilocularis	calpain	0.0484	0.2878	0.2761
Schistosoma mansoni	hypothetical protein	0.0146	0.0185	0.0185
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0484	0.2878	0.3259
Trypanosoma cruzi	cysteine peptidase, putative	0.0394	0.2163	0.245
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0453	0.2626	0.9064
Trypanosoma cruzi	kinesin, putative	0.0339	0.1721	0.1948
Entamoeba histolytica	cysteine proteinase, putative	0.0226	0.0821	0.3215
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1377	0.998	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0394	0.2163	0.2167
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0484	0.2878	0.3259
Entamoeba histolytica	cysteine proteinase, putative	0.0226	0.0821	0.3215
Brugia malayi	cathepsin B-like cysteine proteinase	0.1233	0.8831	0.956
Schistosoma mansoni	calpain-2 (C02 family)	0.0146	0.0185	0.0185
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0146	0.0185	0.0209
Loa Loa (eye worm)	fibroinase	0.0394	0.2163	0.2342
Echinococcus multilocularis	cathepsin L	0.0226	0.0821	0.0669
Loa Loa (eye worm)	hypothetical protein	0.0272	0.119	0.1289
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0453	0.2626	0.2974
Echinococcus multilocularis	cathepsin L cysteine protease	0.0394	0.2163	0.2034
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0226	0.0821	0.0823
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Giardia lamblia	Cathepsin B precursor	0.0453	0.2626	0.5
Plasmodium vivax	vivapain-2	0.0394	0.2163	0.7515
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Brugia malayi	calpain family protein 1	0.1284	0.9237	1
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0226	0.0821	0.093
Echinococcus multilocularis	cathepsin b	0.1233	0.8831	0.8811
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	0.3259
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0226	0.0821	0.0823
Onchocerca volvulus		0.0394	0.2163	0.294
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.0209	0.0687	0.0778
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.0209	0.0687	0.1863
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1233	0.8831	1
Onchocerca volvulus		0.0394	0.2163	0.294
Echinococcus multilocularis	cathepsin L cysteine protease	0.0394	0.2163	0.2034
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Echinococcus multilocularis	hypothetical protein	0.0484	0.2878	0.2761
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0394	0.2163	0.7345
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Echinococcus multilocularis	cathepsin b	0.1233	0.8831	0.8811
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	1
Schistosoma mansoni	calpain-7 (C02 family)	0.0484	0.2878	0.2884
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Trypanosoma cruzi	cysteine peptidase, putative	0.0226	0.0821	0.093
Loa Loa (eye worm)	hypothetical protein	0.1284	0.9237	1
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Trypanosoma cruzi	cysteine proteinase, putative	0.0226	0.0821	0.093
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.1284	0.9237	0.9255
Loa Loa (eye worm)	hypothetical protein	0.0146	0.0185	0.02
Trypanosoma brucei	antigen, putative	0.0484	0.2878	1
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Loa Loa (eye worm)	hypothetical protein	0.1138	0.8079	0.8747
Leishmania major	cathepsin L-like protease	0.0394	0.2163	0.7345
Trypanosoma brucei	calpain-like protein, putative	0.0484	0.2878	1
Loa Loa (eye worm)	hypothetical protein	0.0799	0.5385	0.583
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Loa Loa (eye worm)	calpain family protein 1	0.1284	0.9237	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0394	0.2163	0.8104
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0484	0.2878	0.3259
Loa Loa (eye worm)	hypothetical protein	0.1233	0.8831	0.956
Onchocerca volvulus		0.0394	0.2163	0.294
Entamoeba histolytica	cysteine proteinase, putative	0.0226	0.0821	0.3215
Brugia malayi	calpain 5	0.0146	0.0185	0.02
Brugia malayi	calpain 7	0.0484	0.2878	0.3116
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1233	0.8831	0.8848
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0394	0.2163	0.8104
Brugia malayi	Cathepsin L-like precursor	0.0394	0.2163	0.2342
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0272	0.119	0.1348
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0394	0.2163	1
Entamoeba histolytica	cysteine protease, putative	0.0394	0.2163	1
Echinococcus granulosus	cathepsin l1	0.0394	0.2163	0.2034
Schistosoma mansoni	caspase-7 (C14 family)	0.0247	0.0991	0.0993
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0146	0.0185	0.0209
Loa Loa (eye worm)	hypothetical protein	0.0226	0.0821	0.0889
Brugia malayi	cathepsin L-like precursor	0.0272	0.119	0.1289
Plasmodium vivax	unspecified product	0.0226	0.0821	0.2852
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0226	0.0821	0.3215
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Brugia malayi	Dihydrofolate reductase	0.0209	0.0687	0.0743
Schistosoma mansoni	calpain C (C02 family)	0.0484	0.2878	0.2884
Entamoeba histolytica	cysteine proteinase, putative	0.0272	0.119	0.5082
Entamoeba histolytica	cysteine proteinase, putative	0.0226	0.0821	0.3215
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0146	0.0185	0.0209
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0146	0.0185	0.0209
Entamoeba histolytica	cysteine proteinase 2	0.0226	0.0821	0.3215
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0394	0.2163	0.2034
Loa Loa (eye worm)	dihydrofolate reductase	0.0209	0.0687	0.0743
Entamoeba histolytica	protein kinase, putative	0.0339	0.1721	0.7763
Brugia malayi	Cell death protein 3 precursor	0.0226	0.0821	0.0889
Echinococcus multilocularis	calpain A	0.138	1	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0394	0.2163	0.2342
Entamoeba histolytica	cysteine proteinase, putative	0.0394	0.2163	1
Trypanosoma cruzi	cytoskeleton-associated protein CAP5.5, putative	0.0146	0.0185	0.0209
Trypanosoma brucei	kinesin, putative	0.0339	0.1721	0.5701
Loa Loa (eye worm)	ctsf protein	0.0394	0.2163	0.2342
Entamoeba histolytica	cysteine protease, putative	0.0226	0.0821	0.3215
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0146	0.0185	0.0209

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 1500 nM	Inhibition of binding to human vanilloid receptor subtype VR1	ChEMBL.	15689158
IC50 (binding)	= 1500 nM	Inhibition of binding to human vanilloid receptor subtype VR1	ChEMBL.	15689158

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

PubChem: 11187610

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 313397