TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 427.477 | Formula: C20H21N5O4S
H donors: 1 H acceptors: 3 LogP: 2.61 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Cc1[nH]n(c(=O)c1N=Nc1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccccc1
InChi: 1S/C20H21N5O4S/c1-15-19(20(26)25(23-15)17-7-3-2-4-8-17)22-21-16-6-5-9-18(14-16)30(27,28)24-10-12-29-13-11-24/h2-9,14,23H,10-13H2,1H3
InChiKey: MPXCHLFLMXPWPW-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
Homo sapiens	huntingtin	Starlite/ChEMBL	No references
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	microtubule-associated protein tau	Starlite/ChEMBL	No references
Giardia intestinalis	Putative fructose-1,6-bisphosphate aldolase	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed) iota	Starlite/ChEMBL	No references
Homo sapiens	multiple endocrine neoplasia I		No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Echinococcus granulosus	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Echinococcus multilocularis	dnaJ subfamily B	Get druggable targets OG5_133913	All targets in OG5_133913
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Echinococcus multilocularis	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_133913	All targets in OG5_133913
Brugia malayi	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Giardia lamblia	Fructose-bisphosphate aldolase	Get druggable targets OG5_129214	All targets in OG5_129214
Schistosoma mansoni	microtubule-associated protein tau	Get druggable targets OG5_133504	All targets in OG5_133504
Onchocerca volvulus	Huntingtin homolog	Get druggable targets OG5_132837	All targets in OG5_132837
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma japonicum	ko:K04380 microtubule-associated protein tau, putative	Get druggable targets OG5_133504	All targets in OG5_133504
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132837	All targets in OG5_132837
Treponema pallidum	fructose-bisphosphate aldolase	Get druggable targets OG5_129214	All targets in OG5_129214
Onchocerca volvulus	Huntingtin homolog	Get druggable targets OG5_132837	All targets in OG5_132837
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Schistosoma japonicum	Menin, putative	Get druggable targets OG5_133913	All targets in OG5_133913
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	Get druggable targets OG5_129214	All targets in OG5_129214
Echinococcus granulosus	microtubule associated protein 2	Get druggable targets OG5_133504	All targets in OG5_133504

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	25.8 %
Mycobacterium ulcerans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	26.9 %
Candida albicans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	358 aa	22.6 %
Candida albicans	fructose-bisphosphate aldolase	Putative fructose-1,6-bisphosphate aldolase	323 aa	358 aa	22.6 %
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	Putative fructose-1,6-bisphosphate aldolase	323 aa	361 aa	25.5 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Steroid receptor seven-up type 2	0.0012	0.0014	0.0029
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Mycobacterium ulcerans	aminopeptidase N PepN	0.0196	0.0513	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.0014	0.001
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.0196	0.0513	1
Giardia lamblia	Fructose-bisphosphate aldolase	0.0353	0.094	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.0014	0.0029
Schistosoma mansoni	coup transcription factor	0.0012	0.0014	0.0014
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0012	0.0014	0.001
Trypanosoma cruzi	aminopeptidase, putative	0.0196	0.0513	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Echinococcus multilocularis	ecdysone induced protein 78C	0.0012	0.0014	0.001
Brugia malayi	nuclear hormone receptor	0.0012	0.0014	0.0029
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0012	0.0014	0.0014
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Loa Loa (eye worm)	aminopeptidase N	0.0196	0.0513	0.0513
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Loa Loa (eye worm)	TATA binding protein associated factor	0.0196	0.0513	0.0513
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0012	0.0014	0.0014
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.001	0.0006
Brugia malayi	Peptidase family M1 containing protein	0.0196	0.0513	0.1118
Loa Loa (eye worm)	peptidase family M1 containing protein	0.0196	0.0513	0.0513
Trypanosoma brucei	unspecified product	0.0023	0.0044	0.0853
Trypanosoma brucei	aminopeptidase, putative	0.0196	0.0513	1
Echinococcus granulosus	geminin	0.0165	0.0429	0.0426
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus multilocularis	dnaJ subfamily B	0.0494	0.1324	0.1321
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.0044	0.0853
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0024	0.0469
Echinococcus granulosus	cpg binding protein	0.0037	0.008	0.0076
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.0014	0.0029
Brugia malayi	hypothetical protein	0.0196	0.0513	0.1118
Leishmania major	DNA polymerase eta, putative	0.0023	0.0044	0.0853
Trypanosoma brucei	metallo-peptidase, Clan MA(E) Family M1	0.0196	0.0513	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0012	0.0014	0.0014
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0012	0.0014	0.0014
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0012	0.0014	0.001
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0353	0.094	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Brugia malayi	ecdysteroid receptor	0.0012	0.0014	0.0029
Trypanosoma brucei	Aminopeptidase M1, putative	0.0196	0.0513	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.001	0.0006
Brugia malayi	Peptidase family M1 containing protein	0.0196	0.0513	0.1118
Trichomonas vaginalis	DNA polymerase eta, putative	0.0023	0.0044	0.0448
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0012	0.0014	0.0029
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0172	0.0449	0.8764
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0012	0.0014	0.001
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.0196	0.0513	0.0509
Schistosoma mansoni	RAR-like nuclear receptor	0.0012	0.0014	0.0014
Giardia lamblia	DINP protein human, muc B family	0.0023	0.0044	0.0465
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.0044	0.0095
Plasmodium vivax	M1-family alanyl aminopeptidase, putative	0.0196	0.0513	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0012	0.0014	0.0029
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0012	0.0014	0.001
Echinococcus granulosus	dna polymerase kappa	0.0023	0.0044	0.004
Onchocerca volvulus	Huntingtin homolog	0.0148	0.0383	0.7397
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0012	0.0014	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Trypanosoma brucei	DNA polymerase eta, putative	0.0023	0.0044	0.0853
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0012	0.0014	0.0029
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0196	0.0513	0.0513
Trypanosoma cruzi	Aminopeptidase M1, putative	0.0196	0.0513	1
Plasmodium vivax	M1-family alanyl aminopeptidase, putative	0.0196	0.0513	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Schistosoma mansoni	Tata binding protein associated factor (M01 family)	0.0196	0.0513	0.0513
Echinococcus multilocularis	FTZ F1 alpha	0.0012	0.0014	0.001
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0012	0.0014	0.0029
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.0044	0.0853
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Schistosoma mansoni	cpg binding protein	0.0037	0.008	0.008
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.0196	0.0513	1
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0009	0.002
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.0044	0.0853
Echinococcus granulosus	aminopeptidase N	0.0196	0.0513	0.0509
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0012	0.0014	0.0014
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0172	0.0449	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0075	0.0075
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0012	0.0014	0.001
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.0014	0.0029
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0012	0.0014	0.0014
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0024	0.0469
Mycobacterium ulcerans	aminopeptidase N PepN	0.0196	0.0513	1
Leishmania major	aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.0196	0.0513	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Schistosoma mansoni	DNA polymerase eta	0.0023	0.0044	0.0044
Trypanosoma cruzi	puromycin-sensitive aminopeptidase-like protein, putative	0.0196	0.0513	1
Echinococcus granulosus	microtubule associated protein 2	0.0833	0.2247	0.2244
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0044	0.0044
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0004	0.0004
Brugia malayi	photoreceptor-specific nuclear receptor	0.0012	0.0014	0.0029
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0012	0.0014	0.0014
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0012	0.0014	0.0029
Trypanosoma cruzi	metallo-peptidase, Clan MA(E) Family M1	0.0196	0.0513	1
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0023	0.0044	0.0853
Toxoplasma gondii	aminopeptidase n, putative	0.0196	0.0513	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.0014	0.001
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0012	0.0014	0.001
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0196	0.0513	0.5444
Echinococcus granulosus	dnaJ subfamily B	0.0494	0.1324	0.1321
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0023	0.0044	0.0044
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.001	0.001
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0012	0.0014	0.001
Toxoplasma gondii	aminopeptidase N, putative	0.0196	0.0513	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0353	0.094	1
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.0044	0.0095
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.0024	0.0469
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0012	0.0014	0.0014
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.0196	0.0513	1
Schistosoma mansoni	hypothetical protein	0.0165	0.0429	0.0429
Echinococcus multilocularis	geminin	0.0165	0.0429	0.0426
Schistosoma mansoni	nuclear hormone receptor	0.0012	0.0014	0.0014
Trypanosoma brucei	unspecified product	0.0016	0.0024	0.0469
Trypanosoma cruzi	DNA polymerase eta, putative	0.0023	0.0044	0.0853
Plasmodium falciparum	M1-family alanyl aminopeptidase, putative	0.0196	0.0513	1
Plasmodium falciparum	M1-family alanyl aminopeptidase	0.0196	0.0513	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Echinococcus multilocularis	cpg binding protein	0.0037	0.008	0.0076
Echinococcus multilocularis	aminopeptidase N	0.0196	0.0513	0.0509
Brugia malayi	hypothetical protein	0.0196	0.0513	0.1118
Echinococcus multilocularis	dna polymerase kappa	0.0023	0.0044	0.004
Loa Loa (eye worm)	hypothetical protein	0.0196	0.0513	0.0513
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0012	0.0014	0.0014
Brugia malayi	steroid hormone receptor	0.0012	0.0014	0.0029
Trypanosoma brucei	Aminopeptidase M1, putative	0.0196	0.0513	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.0044	0.0853
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.0014	0.0014
Onchocerca volvulus		0.0196	0.0513	1
Brugia malayi	hypothetical protein	0.1694	0.4587	1
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0023	0.0044	0.004
Leishmania major	puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.0196	0.0513	1
Loa Loa (eye worm)	steroid hormone receptor	0.0012	0.0014	0.0014
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0023	0.0044	0.0044
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0012	0.0014	0.001
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0012	0.0014	0.001
Onchocerca volvulus		0.0035	0.0075	0.1225
Loa Loa (eye worm)	hypothetical protein	0.0196	0.0513	0.0513
Entamoeba histolytica	aminopeptidase, putative	0.0196	0.0513	0.523
Echinococcus granulosus	ecdysone induced protein 78C	0.0012	0.0014	0.001
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.0196	0.0513	1
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.0159	0.3102
Schistosoma mansoni	cpg binding protein	0.0035	0.0075	0.0075
Loa Loa (eye worm)	leukotriene A4 hydrolase	0.3684	1	1
Echinococcus granulosus	FTZ F1 alpha	0.0012	0.0014	0.001
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Treponema pallidum	fructose-bisphosphate aldolase	0.0353	0.094	0.5
Brugia malayi	nuclear receptor NHR-88	0.0012	0.0014	0.0029
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0012	0.0014	0.0014
Trypanosoma cruzi	puromycin-sensitive aminopeptidase-like protein, putative	0.0196	0.0513	1
Schistosoma mansoni	leukotriene A4 hydrolase (M01 family)	0.3684	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0012	0.0014	0.001
Onchocerca volvulus	Huntingtin homolog	0.0148	0.0383	0.7397
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Schistosoma mansoni	aminopeptidase A (M01 family)	0.0196	0.0513	0.0513
Schistosoma mansoni	microtubule-associated protein tau	0.0833	0.2247	0.2247
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.0044	0.0853
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0012	0.0014	0.0029
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0075	0.0163
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Schistosoma mansoni	hypothetical protein	0.0165	0.0429	0.0429
Schistosoma mansoni	hypothetical protein	0.0494	0.1324	0.1324
Leishmania major	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Brugia malayi	TATA binding protein associated factor	0.0196	0.0513	0.1118
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0012	0.0014	0.001
Loa Loa (eye worm)	hypothetical protein	0.0148	0.0383	0.0383
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0012	0.0014	0.0029
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.0196	0.0513	0.0513
Brugia malayi	hypothetical protein	0.0148	0.0383	0.0834
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0196	0.0513	0.5444
Brugia malayi	Peptidase family M1 containing protein	0.0196	0.0513	0.1118
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0023	0.0044	0.004
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0023	0.0044	0.0448
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0012	0.0014	0.0014
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0196	0.0513	0.5444
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0014	0.0014
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0012	0.0014	0.001
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0012	0.0014	0.0029
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0012	0.0014	0.0029
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0172	0.0449	0.5
Toxoplasma gondii	aminopeptidase N protein	0.0196	0.0513	1
Schistosoma mansoni	thyroid hormone receptor	0.0012	0.0014	0.0014
Trypanosoma cruzi	aminopeptidase, putative	0.0196	0.0513	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0012	0.0014	0.0014
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0196	0.0513	0.0509
Onchocerca volvulus		0.0196	0.0513	1
Loa Loa (eye worm)	hypothetical protein	0.0196	0.0513	0.0513
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0012	0.0014	0.0014
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0023	0.0044	0.0044
Loa Loa (eye worm)	hypothetical protein	0.0148	0.0383	0.0383
Echinococcus multilocularis	microtubule associated protein 2	0.0833	0.2247	0.2244
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.018	0.018
Schistosoma mansoni	retinoic acid receptor RXR	0.0012	0.0014	0.0014
Trypanosoma brucei	unspecified product	0.0016	0.0024	0.0469
Onchocerca volvulus		0.0196	0.0513	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.0044	0.0853
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0012	0.0014	0.0014
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0012	0.0014	0.0029
Echinococcus multilocularis	leukotriene A 4 hydrolase	0.3684	1	1
Echinococcus granulosus	dna polymerase eta	0.0023	0.0044	0.004
Echinococcus multilocularis	dna polymerase eta	0.0023	0.0044	0.004
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0353	0.094	1
Schistosoma mansoni	cpg binding protein	0.0037	0.008	0.008

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 4.4563 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ]	ChEMBL.	No reference
Potency (functional)	= 4.4668 um	PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ]	ChEMBL.	No reference
Potency (functional)	= 5.6234 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 7.9433 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (binding)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	17.7828 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference
Potency (binding)	39.8107 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	50.1187 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	56.2341 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference
Potency (functional)	100 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL3144885

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1850801