TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 429.508 | Formula: C22H24FN3O3S
H donors: 0 H acceptors: 3 LogP: 2.76 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CC1C(=O)N2c3c1cc(cc3CCC2)S(=O)(=O)N1CCN(CC1)c1ccccc1F
InChi: 1S/C22H24FN3O3S/c1-15-18-14-17(13-16-5-4-8-26(21(16)18)22(15)27)30(28,29)25-11-9-24(10-12-25)20-7-3-2-6-19(20)23/h2-3,6-7,13-15H,4-5,8-12H2,1H3
InChiKey: KOXRFDJSBGMYDY-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No 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
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.0369	0.0369
Onchocerca volvulus		0.0012	0.0369	0.0991
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Echinococcus granulosus	transient receptor potential ion channel A	0.0085	0.8621	0.8621
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0017	0.0957	0.0673
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	1	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.1096	0.1096
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.006	0.5848	0.8997
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0012	0.0369	0.0369
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.1096	0.1274
Schistosoma mansoni	retinoic acid receptor RXR	0.0012	0.0369	0.0369
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	1	1
Leishmania major	cathepsin L-like protease	0.0066	0.6501	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Schistosoma mansoni	transient receptor potential channel 4	0.0088	0.8953	0.8953
Echinococcus granulosus	ecdysone induced protein 78C	0.0012	0.0369	0.0369
Leishmania major	cathepsin L-like protease	0.0066	0.6501	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0057	0.549	0.5349
Trypanosoma cruzi	major cysteine proteinase, putative	0.0052	0.4892	0.7525
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0029	0.2298	0.2671
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.1096	1
Brugia malayi	RNA binding protein	0.0057	0.549	0.549
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Leishmania major	cathepsin L-like protease	0.0066	0.6501	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0012	0.0369	0.0067
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.1096	0.0816
Toxoplasma gondii	hypothetical protein	0.0029	0.2298	0.1754
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.1096	0.1096
Plasmodium vivax	vivapain-2	0.0017	0.0957	0.1112
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0012	0.0369	0.0369
Echinococcus granulosus	tar DNA binding protein	0.0057	0.549	0.549
Schistosoma mansoni	transient receptor potential channel	0.0058	0.5578	0.5578
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.0369	0.0369
Brugia malayi	Transient-receptor-potential like protein	0.0033	0.2692	0.2692
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0017	0.0957	0.0957
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0012	0.0369	0.0067
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Onchocerca volvulus	Cathepsin L homolog	0.0017	0.0957	1
Echinococcus granulosus	cathepsin l1	0.0012	0.0304	0.0304
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.1096	0.0251
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0012	0.0369	0.0369
Onchocerca volvulus	Cathepsin F homolog	0.0017	0.0957	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0017	0.0957	0.1112
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.0369	0.0369
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.1096	0.1096
Loa Loa (eye worm)	RNA binding protein	0.0057	0.549	0.5349
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0012	0.0369	0.0369
Echinococcus multilocularis	cathepsin L cysteine protease	0.0017	0.0957	0.0957
Brugia malayi	steroid hormone receptor	0.0012	0.0369	0.0369
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.1096	0.5
Entamoeba histolytica	cysteine proteinase, putative	0.0012	0.0304	0.2778
Echinococcus granulosus	TRP transient receptor potential channel	0.0033	0.2692	0.2692
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Entamoeba histolytica	cysteine proteinase, putative	0.0017	0.0957	0.8729
Schistosoma mansoni	coup transcription factor	0.0012	0.0369	0.0369
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	0.5
Brugia malayi	Cathepsin L-like precursor	0.0012	0.0304	0.0304
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0033	0.2692	0.2692
Schistosoma mansoni	ap endonuclease	0.0019	0.1096	0.1096
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0012	0.0369	0.0369
Echinococcus multilocularis	FTZ F1 alpha	0.0012	0.0369	0.0369
Onchocerca volvulus		0.0017	0.0957	1
Brugia malayi	cathepsin L-like precursor	0.0012	0.0304	0.0304
Schistosoma mansoni	tar DNA-binding protein	0.0057	0.549	0.549
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Trypanosoma cruzi	cruzipain precursor, putative	0.0066	0.6501	1
Echinococcus multilocularis	cysteine protease	0.0017	0.0957	0.0957
Schistosoma mansoni	peptidase Clp (S14 family)	0.0085	0.8603	0.8603
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.1096	0.1686
Brugia malayi	Nuclear hormone receptor-like 1	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0012	0.0304	0.2778
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0097	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0057	0.549	0.549
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Trypanosoma cruzi	cysteine peptidase, putative	0.0066	0.6501	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.1096	0.1686
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0012	0.0369	0.0369
Echinococcus multilocularis	short transient receptor potential channel 6	0.0058	0.5578	0.5578
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0097	1	1
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0085	0.8603	0.8603
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0012	0.0369	0.0369
Echinococcus granulosus	peptidase Clp S14 family	0.0056	0.5289	0.5289
Schistosoma mansoni	tar DNA-binding protein	0.0057	0.549	0.549
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Echinococcus granulosus	transient receptor potential gamma protein	0.0088	0.8953	0.8953
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0056	0.5289	0.5289
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0012	0.0369	0.0369
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0.0957	0.8729
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0029	0.2298	0.2671
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0085	0.8603	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0017	0.0957	0.0957
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0088	0.8953	0.8921
Echinococcus multilocularis	short transient receptor potential channel 6	0.0058	0.5578	0.5578
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Echinococcus granulosus	FTZ F1 alpha	0.0012	0.0369	0.0369
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0017	0.0957	0.1112
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0012	0.0369	0.0369
Trypanosoma cruzi	cysteine peptidase, putative	0.0066	0.6501	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0.0957	0.8729
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.0369	0.0369
Entamoeba histolytica	cysteine protease, putative	0.0017	0.0957	0.8729
Brugia malayi	Probable ClpP-like protease	0.0085	0.8603	0.8603
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0085	0.8603	0.8559
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Loa Loa (eye worm)	steroid hormone receptor	0.0012	0.0369	0.0067
Onchocerca volvulus		0.0017	0.0957	1
Onchocerca volvulus	Cathepsin L homolog	0.0017	0.0957	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0056	0.5289	1
Loa Loa (eye worm)	TAR-binding protein	0.0057	0.549	0.5349
Schistosoma mansoni	tar DNA-binding protein	0.0057	0.549	0.549
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0012	0.0369	0.0369
Schistosoma mansoni	nuclear hormone receptor	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0017	0.0957	0.1112
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0012	0.0369	0.0369
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.1096	0.1686
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0012	0.0369	0.0369
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0056	0.5289	0.4744
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0012	0.0369	0.0369
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Schistosoma mansoni	ap endonuclease	0.0019	0.1096	0.1096
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0097	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Brugia malayi	nuclear hormone receptor	0.0012	0.0369	0.0369
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0017	0.0957	0.0957
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0012	0.0369	0.0067
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0012	0.0304	0.0304
Onchocerca volvulus		0.0017	0.0957	1
Onchocerca volvulus		0.0017	0.0957	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Trypanosoma cruzi	cysteine peptidase, putative	0.0066	0.6501	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0012	0.0369	0.0067
Brugia malayi	Steroid receptor seven-up type 2	0.0012	0.0369	0.0369
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0012	0.0304	0.0304
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0017	0.0957	0.0673
Schistosoma mansoni	cathepsin F (C01 family)	0.0017	0.0957	0.0957
Onchocerca volvulus		0.0017	0.0957	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Echinococcus multilocularis	transient receptor potential ion channel A	0.0085	0.8621	0.8621
Onchocerca volvulus	Bile acid receptor homolog	0.0012	0.0369	0.0991
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0012	0.0369	0.0991
Onchocerca volvulus	Protein ultraspiracle homolog	0.0012	0.0369	0.0991
Echinococcus granulosus	cathepsin l1	0.0017	0.0957	0.0957
Entamoeba histolytica	cysteine proteinase, putative	0.0017	0.0957	0.8729
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Toxoplasma gondii	exonuclease III APE	0.0019	0.1096	0.0182
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.1096	0.1274
Trypanosoma cruzi	cysteine peptidase, putative	0.0017	0.0957	0.1472
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0012	0.0369	0.0369
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0085	0.8603	0.8603
Brugia malayi	Papain family cysteine protease containing protein	0.0017	0.0957	0.0957
Echinococcus granulosus	short transient receptor potential channel 6	0.0058	0.5578	0.5578
Brugia malayi	nuclear receptor NHR-88	0.0012	0.0369	0.0369
Echinococcus granulosus	short transient receptor potential channel 6	0.0058	0.5578	0.5578
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0012	0.0369	0.0067
Brugia malayi	ecdysteroid receptor	0.0012	0.0369	0.0369
Onchocerca volvulus		0.0017	0.0957	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0056	0.5289	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	1	1
Schistosoma mansoni	RAR-like nuclear receptor	0.0012	0.0369	0.0369
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0012	0.0369	0.0369
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.1096	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0085	0.8603	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0012	0.0369	0.0369
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0085	0.8603	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0012	0.0304	0.2778
Echinococcus multilocularis	transient receptor potential gamma protein	0.0088	0.8953	0.8953
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	1
Loa Loa (eye worm)	hypothetical protein	0.0055	0.5246	0.5096
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.0369	0.0369
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0012	0.0369	0.0067
Plasmodium vivax	vivapain-2	0.0017	0.0957	0.1112
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.0957	0.8729
Schistosoma mansoni	transient receptor potential channel	0.0058	0.5578	0.5578
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.1096	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Loa Loa (eye worm)	cysteine protease	0.0017	0.0957	0.0673
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0097	1	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.0369	0.0369
Brugia malayi	RNA recognition motif domain containing protein	0.0057	0.549	0.549
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0017	0.0957	0.0957
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0012	0.0369	0.0067
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0012	0.0369	0.0369
Schistosoma mansoni	tar DNA-binding protein	0.0057	0.549	0.549
Brugia malayi	Cathepsin L-like precursor	0.0017	0.0957	0.0957
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Brugia malayi	Cathepsin L-like precursor	0.0012	0.0304	0.0304
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.0369	0.0369
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0017	0.0957	0.0957
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0085	0.8603	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Echinococcus multilocularis	ecdysone induced protein 78C	0.0012	0.0369	0.0369
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0029	0.2298	0.1601
Echinococcus multilocularis	tar DNA binding protein	0.0057	0.549	0.549
Loa Loa (eye worm)	hypothetical protein	0.003	0.2359	0.2119
Echinococcus multilocularis	cathepsin L cysteine protease	0.0017	0.0957	0.0957
Brugia malayi	TAR-binding protein	0.0057	0.549	0.549
Loa Loa (eye worm)	ctsf protein	0.0017	0.0957	0.0673
Onchocerca volvulus		0.0017	0.0957	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0957	0.0673
Loa Loa (eye worm)	fibroinase	0.0017	0.0957	0.0673
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0369	0.0067
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.0369	0.0369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Echinococcus multilocularis	cysteine protease	0.0017	0.0957	0.0957
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.0957	0.8729
Schistosoma mansoni	transient receptor potential channel	0.0088	0.8953	0.8953
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.0369	0.0369
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0097	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0066	0.6501	1
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0085	0.8603	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.0369	0.0369
Loa Loa (eye worm)	hypothetical protein	0.0033	0.2692	0.2462

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 2.5119 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	4.6535 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	11.6891 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	23.1093 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	70.7946 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1358812

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1194149