TDR Targets

Basic information

Technical information

TDR Targets ID: 1444027
Name: N-[4-[2-(2,3-dimethylimidazo[1,2-b][1,2,4]tri azin-6-yl)ethylsulfamoyl]phenyl]acetamide
MW: 388.444 | Formula: C17H20N6O3S
H donors: 2 H acceptors: 6 LogP: 0.61 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)Nc1ccc(cc1)S(=O)(=O)NCCc1cn2c(n1)nc(c(n2)C)C
InChi: 1S/C17H20N6O3S/c1-11-12(2)22-23-10-15(21-17(23)19-11)8-9-18-27(25,26)16-6-4-14(5-7-16)20-13(3)24/h4-7,10,18H,8-9H2,1-3H3,(H,20,24)
InChiKey: YQEHWVQMCBBZOY-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

N-[4-[2-(2,3-dimethyl-6-imidazo[1,2-b][1,2,4]triazinyl)ethylsulfamoyl]phenyl]acetamide
N-[4-[2-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)ethylsulfamoyl]phenyl]ethanamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Homo sapiens	ataxin 2	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0036	0.0005	0.0018
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0006	0.0096
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0037	0.0006	0.0096
Plasmodium falciparum	acid cluster protein 33 homologue, putative	0.0037	0.0006	0.0096
Mycobacterium tuberculosis	Possible haloalkane dehalogenase DhaA (1-chlorohexane halidohydrolase)	0.0037	0.0006	0.0006
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0252	0.0614	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0005	0.0018
Echinococcus multilocularis		0.0252	0.0614	0.2357
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Schistosoma mansoni	amine oxidase	0.0252	0.0614	0.2357
Brugia malayi	Hypothetical 54.7 kDa protein F37A4.1 in chromosome III	0.0037	0.0006	0.0023
Trypanosoma cruzi	hydrolase-like protein	0.0037	0.0006	0.0096
Schistosoma mansoni	family S33 non-peptidase homologue (S33 family)	0.0037	0.0006	0.0023
Brugia malayi	Carboxylesterase family protein	0.0959	0.2605	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0059	0.0225
Echinococcus granulosus	lysosomal acid lipase:cholesteryl ester	0.0037	0.0006	0.0023
Onchocerca volvulus		0.0162	0.036	0.5072
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Mycobacterium tuberculosis	Probable oxidoreductase	0.0037	0.0006	0.0006
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.3331	0.9289	1
Loa Loa (eye worm)	carboxylesterase	0.0162	0.036	0.138
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0162	0.036	0.138
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0059	0.0225
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Brugia malayi	hypothetical protein	0.0162	0.036	0.138
Trypanosoma brucei	hydrolase, alpha/beta fold family, putative	0.0037	0.0006	1
Toxoplasma gondii	homoserine O-acetyltransferase, putative	0.0037	0.0006	0.0022
Echinococcus granulosus	abhydrolase domain containing protein 11	0.0037	0.0006	0.0023
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0252	0.0614	1
Mycobacterium ulcerans	2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate hydrolase BphD	0.0037	0.0006	0.0006
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.0059	0.0225
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0036	0.0005	0.0018
Mycobacterium ulcerans	epoxide hydrolase EphE	0.0037	0.0006	0.0006
Wolbachia endosymbiont of Brugia malayi	phosphatase	0.0034	0	0.5
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.3584	1	1
Mycobacterium tuberculosis	Probable homoserine O-acetyltransferase MetA (homoserine O-trans-acetylase) (homoserine transacetylase) (HTA)	0.0037	0.0006	0.0006
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0162	0.036	0.138
Onchocerca volvulus	Lipase homolog	0.0037	0.0006	0.0083
Mycobacterium ulcerans	lignin peroxidase LipJ	0.0037	0.0006	0.0006
Mycobacterium ulcerans	epoxide hydrolase EphA	0.133	0.3651	0.3651
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0252	0.0614	0.2357
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0162	0.036	0.138
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0006	0.0023
Mycobacterium ulcerans	non-heme haloperoxidase Hpx	0.0037	0.0006	0.0006
Mycobacterium ulcerans	epoxide hydrolase EphF	0.0037	0.0006	0.0006
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Onchocerca volvulus	Epoxide hydrolase 1 homolog	0.0037	0.0006	0.0083
Mycobacterium leprae	Probable exported protease	0.0037	0.0006	0.0096
Echinococcus granulosus	para nitrobenzyl esterase	0.0162	0.036	0.138
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0162	0.036	0.138
Schistosoma mansoni	gliotactin	0.0162	0.036	0.138
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Loa Loa (eye worm)	acetylcholinesterase 1	0.0959	0.2605	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0959	0.2605	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0059	0.0225
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0252	0.0614	1
Mycobacterium ulcerans	proline iminopeptidase PIP	0.0037	0.0006	0.0006
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Echinococcus granulosus	abhydrolase domain containing protein	0.0037	0.0006	0.0023
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0252	0.0614	1
Mycobacterium ulcerans	haloalkane dehalogenase	0.0037	0.0006	0.0006
Echinococcus granulosus	abhydrolase domain containing protein 3	0.0037	0.0006	0.0023
Mycobacterium ulcerans	peroxidase BpoB	0.0037	0.0006	0.0006
Mycobacterium tuberculosis	Possible short-chain dehydrogenase EphD	0.0037	0.0006	0.0006
Echinococcus granulosus	acetylcholinesterase	0.0959	0.2605	1
Mycobacterium tuberculosis	Possible haloalkane dehalogenase	0.0037	0.0006	0.0006
Treponema pallidum	phosphoglycolate phosphatase	0.0034	0	0.5
Echinococcus multilocularis	abhydrolase domain containing protein	0.0037	0.0006	0.0023
Mycobacterium ulcerans	dehydrogenase	0.0252	0.0614	0.0614
Echinococcus multilocularis	abhydrolase domain containing 3	0.0037	0.0006	0.0023
Brugia malayi	Carboxylesterase family protein	0.0959	0.2605	1
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0252	0.0614	1
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0162	0.036	0.5072
Mycobacterium tuberculosis	Probable carboxylesterase CaeA	0.0037	0.0006	0.0006
Plasmodium falciparum	epoxide hydrolase 1	0.0037	0.0006	0.0096
Onchocerca volvulus		0.0162	0.036	0.5072
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0252	0.0614	0.2357
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.0611	0.2346
Trypanosoma cruzi	hydrolase, alpha/beta fold family, putative	0.0037	0.0006	0.0096
Brugia malayi	hydrolase, alpha/beta fold family protein	0.0037	0.0006	0.0023
Entamoeba histolytica	hypothetical protein	0.0037	0.0006	1
Trypanosoma brucei	hydrolase, alpha/beta fold family, putative	0.0037	0.0006	1
Brugia malayi	amine oxidase, flavin-containing family protein	0.0252	0.0614	0.2357
Mycobacterium leprae	Probable exported protease	0.0037	0.0006	0.0096
Brugia malayi	Carboxylesterase family protein	0.0162	0.036	0.138
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Brugia malayi	Alpha/beta hydrolase	0.0037	0.0006	0.0023
Mycobacterium ulcerans	hydrolase	0.0037	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Brugia malayi	Pre-SET motif family protein	0.0251	0.0611	0.2346
Mycobacterium leprae	Possible short-chain dehydrogenase EphD	0.0037	0.0006	0.0096
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0006	0.0096
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.0709	1
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.0059	0.0225
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Mycobacterium ulcerans	hydrolase	0.0037	0.0006	0.0006
Giardia lamblia	ENC6 protein	0.0037	0.0006	1
Mycobacterium leprae	Probable homoserine o-acetyltransferase MetA	0.0037	0.0006	0.0096
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0162	0.036	0.0387
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0252	0.0614	1
Schistosoma mansoni	BC026374 protein (S09 family)	0.0162	0.036	0.138
Echinococcus multilocularis	lysosomal acid lipase:cholesteryl ester	0.0037	0.0006	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Echinococcus multilocularis	acetylcholinesterase	0.0959	0.2605	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0162	0.036	0.138
Entamoeba histolytica	alpha/beta hydrolase domain protein, putative	0.0037	0.0006	1
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0006	0.0096
Plasmodium vivax	SET domain protein, putative	0.0036	0.0005	0.0075
Brugia malayi	Pre-SET motif family protein	0.0036	0.0005	0.0018
Echinococcus multilocularis	acetylcholinesterase	0.0959	0.2605	1
Mycobacterium tuberculosis	Probable exported protease	0.0037	0.0006	0.0006
Brugia malayi	SWIRM domain containing protein	0.0252	0.0614	0.2357
Loa Loa (eye worm)	carboxylesterase	0.0162	0.036	0.138
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Mycobacterium tuberculosis	Possible epoxide hydrolase EphE (epoxide hydratase) (arene-oxide hydratase)	0.0037	0.0006	0.0006
Mycobacterium ulcerans	epoxide hydrolase EphB	0.0037	0.0006	0.0006
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.0059	0.0225
Onchocerca volvulus		0.0286	0.0709	1
Trypanosoma cruzi	hydrolase-like protein, putative	0.0037	0.0006	0.0096
Mycobacterium ulcerans	oxidoreductase	0.0252	0.0614	0.0614
Mycobacterium ulcerans	homoserine O-acetyltransferase	0.0037	0.0006	0.0006
Mycobacterium ulcerans	oxidoreductase	0.0037	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0959	0.2605	1
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0252	0.0614	0.0661
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0006	0.0006
Echinococcus granulosus	acetylcholinesterase	0.0959	0.2605	1
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0162	0.036	0.138
Toxoplasma gondii	histone lysine-specific demethylase	0.0252	0.0614	1
Mycobacterium ulcerans	bromoperoxidase BpoC	0.0037	0.0006	0.0006
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0005	0.0018
Mycobacterium tuberculosis	Possible peroxidase BpoB (non-haem peroxidase)	0.0037	0.0006	0.0006
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0162	0.036	0.0387
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Brugia malayi	hypothetical protein	0.0252	0.0614	0.2357
Echinococcus granulosus	neuroligin	0.0162	0.036	0.138
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0059	0.0225
Plasmodium vivax	hypothetical protein, conserved	0.0252	0.0614	1
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.0001	0.0003
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0005	0.0018
Loa Loa (eye worm)	abhydrolase domain-containing protein 2	0.0037	0.0006	0.0023
Echinococcus granulosus	carboxylesterase 5A	0.0959	0.2605	1
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.0005	0.0018
Echinococcus multilocularis	neuroligin	0.0162	0.036	0.138
Mycobacterium leprae	POSSIBLE SECRETED PROTEASE	0.0037	0.0006	0.0096
Mycobacterium ulcerans	short chain dehydrogenase	0.0037	0.0006	0.0006
Mycobacterium ulcerans	lipase/esterase	0.0037	0.0006	0.0006
Mycobacterium ulcerans	exported protease	0.0037	0.0006	0.0006
Schistosoma mansoni	amine oxidase	0.0252	0.0614	0.2357
Onchocerca volvulus	Lipase homolog	0.0037	0.0006	0.0083
Brugia malayi	Carboxylesterase family protein	0.0162	0.036	0.138
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0036	0.0005	0.0018
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0005	0.0018
Brugia malayi	Carboxylesterase family protein	0.0162	0.036	0.138
Schistosoma mansoni	hydrolase	0.0037	0.0006	0.0023
Echinococcus multilocularis	abhydrolase domain containing protein 3	0.0037	0.0006	0.0023
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0006	0.0096
Mycobacterium ulcerans	monoamine oxidase	0.0252	0.0614	0.0614
Chlamydia trachomatis	protoporphyrinogen oxidase	0.0252	0.0614	1
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0006	0.0096
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0006	0.0006
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0252	0.0614	0.2357
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.0059	0.0225
Onchocerca volvulus		0.0162	0.036	0.5072
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0162	0.036	0.0387
Brugia malayi	alpha/beta hydrolase	0.0037	0.0006	0.0023
Schistosoma mansoni	acetylcholinesterase	0.0162	0.036	0.138
Echinococcus multilocularis	abhydrolase domain containing protein 11	0.0037	0.0006	0.0023
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0252	0.0614	1
Treponema pallidum	phosphoglycolate phosphatase	0.0034	0	0.5
Trichomonas vaginalis	spcc417.12 protein, putative	0.0162	0.036	0.5072
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0252	0.0614	0.2357
Echinococcus multilocularis	abhydrolase domain containing protein 16A	0.0037	0.0006	0.0023
Echinococcus granulosus	BC026374 protein S09 family	0.0162	0.036	0.138
Mycobacterium tuberculosis	Probable haloalkane dehalogenase	0.0037	0.0006	0.0006
Onchocerca volvulus		0.0252	0.0614	0.8661
Echinococcus multilocularis	para nitrobenzyl esterase	0.0162	0.036	0.138
Loa Loa (eye worm)	ab-hydrolase associated lipase region family protein	0.0037	0.0006	0.0023
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0252	0.0614	0.0614
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.0059	0.0225
Trichomonas vaginalis	hydrolase, putative	0.0037	0.0006	0.0083
Onchocerca volvulus		0.0036	0.0005	0.0065
Echinococcus multilocularis	lysosomal acid lipase:cholesteryl ester	0.0037	0.0006	0.0023
Mycobacterium ulcerans	acyl-CoA synthetase	0.0037	0.0006	0.0006
Mycobacterium ulcerans	haloalkane dehalogenase	0.0037	0.0006	0.0006
Mycobacterium tuberculosis	Possible oxidoreductase	0.0252	0.0614	0.0661
Loa Loa (eye worm)	hypothetical protein	0.0959	0.2605	1
Brugia malayi	UPF0017 protein CG3488	0.0037	0.0006	0.0023
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0037	0.0006	0.0083
Brugia malayi	hydrolase, alpha/beta fold family protein	0.0037	0.0006	0.0023
Entamoeba histolytica	alpha/beta hydrolase fold protein, putative	0.0037	0.0006	1
Plasmodium vivax	alpha/beta hydrolase, putative	0.0037	0.0006	0.0096
Loa Loa (eye worm)	carboxylesterase	0.0959	0.2605	1
Onchocerca volvulus		0.0162	0.036	0.5072
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Mycobacterium leprae	POSSIBLE EPOXIDE HYDROLASE EPHE (EPOXIDE HYDRATASE) (ARENE-OXIDE HYDRATASE)	0.0037	0.0006	0.0096
Mycobacterium tuberculosis	Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase)	0.133	0.3651	0.3931
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0252	0.0614	1
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0006	0.0023
Onchocerca volvulus		0.0162	0.036	0.5072
Mycobacterium tuberculosis	Possible epoxide hydrolase EphF (epoxide hydratase) (arene-oxide hydratase)	0.0037	0.0006	0.0006
Plasmodium vivax	hypothetical protein, conserved	0.0252	0.0614	1
Mycobacterium ulcerans	carboxylesterase, LipT	0.0162	0.036	0.036
Trichomonas vaginalis	valacyclovir hydrolase, putative	0.0037	0.0006	0.0083
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0252	0.0614	0.2357
Plasmodium falciparum	protoporphyrinogen oxidase	0.0252	0.0614	1
Loa Loa (eye worm)	hypothetical protein	0.0162	0.036	0.138
Mycobacterium ulcerans	lipase/esterase	0.0037	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0252	0.0614	0.2357
Echinococcus multilocularis	carboxylesterase 5A	0.0959	0.2605	1
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0006	0.0006
Trypanosoma cruzi	hydrolase-like protein, putative	0.0037	0.0006	0.0096
Brugia malayi	Carboxylesterase family protein	0.0162	0.036	0.138
Mycobacterium ulcerans	exported protease	0.0037	0.0006	0.0006
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0006	0.0096
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0252	0.0614	0.2357
Loa Loa (eye worm)	hydrolase	0.0037	0.0006	0.0023
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0162	0.036	0.138
Toxoplasma gondii	alpha/beta hydrolase, putative	0.0037	0.0006	0.0022
Leishmania major	UDP-galactopyranose mutase	0.0252	0.0614	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.8913 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)	8.9125 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
Potency (functional)	14.1254 uM	PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (binding)	25.1189 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (binding)	= 31.6228 um	PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845]	ChEMBL.	No reference
Potency (functional)	79.4328 uM	PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 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

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: CHEMBL1601793

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1444027