TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 406.478 | Formula: C23H26N4O3
H donors: 1 H acceptors: 4 LogP: 3.23 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COCC1CCCCN1C(=O)n1ncc(n1)C(c1ccccc1)(c1ccccc1)O
InChi: 1S/C23H26N4O3/c1-30-17-20-14-8-9-15-26(20)22(28)27-24-16-21(25-27)23(29,18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,16,20,29H,8-9,14-15,17H2,1H3
InChiKey: LSXLDKIWQMQUDR-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	abhydrolase domain containing 11	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania donovani	Alpha/beta hydrolase family, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Candida albicans	match to pfam alpha/beta hydrolase fold	Get druggable targets OG5_128173	All targets in OG5_128173
Plasmodium knowlesi	alpha/beta hydrolase, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Plasmodium berghei	alpha/beta hydrolase, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Brugia malayi	hydrolase, alpha/beta fold family protein	Get druggable targets OG5_128173	All targets in OG5_128173
Neospora caninum	hydrolase, alpha/beta fold family domain- containing protein, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128173	All targets in OG5_128173
Mycobacterium ulcerans	hydrolase	Get druggable targets OG5_128173	All targets in OG5_128173
Schistosoma japonicum	ko:K01175 ABHD11,abhydrolase domain containing 11 [EC:3.1.-.-], putative	Get druggable targets OG5_128173	All targets in OG5_128173
Leishmania braziliensis	hypothetical protein, conserved	Get druggable targets OG5_128173	All targets in OG5_128173
Leishmania infantum	hypothetical protein, conserved	Get druggable targets OG5_128173	All targets in OG5_128173
Echinococcus granulosus	abhydrolase domain containing protein 11	Get druggable targets OG5_128173	All targets in OG5_128173
Candida albicans	similar to S. cerevisiae YGR031W	Get druggable targets OG5_128173	All targets in OG5_128173
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Mycobacterium tuberculosis	Possible hydrolase	Get druggable targets OG5_128173	All targets in OG5_128173
Candida albicans	similar to S. cerevisiae YGR031W	Get druggable targets OG5_128173	All targets in OG5_128173
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Toxoplasma gondii	hydrolase, alpha/beta fold family protein	Get druggable targets OG5_128173	All targets in OG5_128173
Trypanosoma congolense	Alpha/beta hydrolase family, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Leishmania major	hypothetical protein, conserved	Get druggable targets OG5_128173	All targets in OG5_128173
Plasmodium vivax	alpha/beta hydrolase, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Trypanosoma brucei gambiense	hypothetical protein, conserved	Get druggable targets OG5_128173	All targets in OG5_128173
Plasmodium yoelii	putative esterase/lipase hi0193	Get druggable targets OG5_128173	All targets in OG5_128173
Echinococcus multilocularis	abhydrolase domain containing protein 11	Get druggable targets OG5_128173	All targets in OG5_128173
Trypanosoma brucei	Alpha/beta hydrolase family, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Candida albicans	match to pfam alpha/beta hydrolase fold	Get druggable targets OG5_128173	All targets in OG5_128173
Schistosoma mansoni	family S33 non-peptidase homologue (S33 family)	Get druggable targets OG5_128173	All targets in OG5_128173
Plasmodium falciparum	alpha/beta hydrolase, putative	Get druggable targets OG5_128173	All targets in OG5_128173
Leishmania mexicana	hypothetical protein, conserved	Get druggable targets OG5_128173	All targets in OG5_128173

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Mycobacterium tuberculosis	Possible peroxidase BpoB (non-haem peroxidase)	abhydrolase domain containing 11	227 aa	238 aa	26.9 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.1289	0.2308
Schistosoma mansoni	hypothetical protein	0.0035	0.2803	0.5021
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.1289	0.21
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.1289	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0325	0.0325
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.1289	0.21
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.2803	0.5021
Brugia malayi	MH1 domain containing protein	0.0004	0.0009	0.0009
Echinococcus granulosus	Smad4	0.0008	0.0325	0.0583
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0011	0.0619	0.1108
Giardia lamblia	Hypothetical protein	0.0006	0.0171	0.1327
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0034	0.2647	0.4314
Mycobacterium tuberculosis	Possible hydrolase	0.0072	0.6136	1
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	0.0072	0.6136	1
Echinococcus granulosus	inositol monophosphatase 1	0.0038	0.3001	0.5376
Mycobacterium ulcerans	hydrolase	0.0006	0.0171	0.0279
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0325	0.0583
Mycobacterium ulcerans	hypothetical protein	0.0006	0.0171	0.0279
Mycobacterium ulcerans	hydrolase	0.0072	0.6136	1
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0397	0.0397
Echinococcus granulosus	cpg binding protein	0.003	0.2315	0.4146
Mycobacterium tuberculosis	Possible haloalkane dehalogenase	0.0006	0.0171	0.0279
Trypanosoma cruzi	hypothetical protein, conserved	0.0006	0.0171	0.0279
Mycobacterium leprae	conserved hypothetical protein	0.0006	0.0171	0.0646
Mycobacterium ulcerans	hydrolase	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Bacterioferritin BfrB	0.0008	0.0368	0.0601
Schistosoma mansoni	protein phosphatase methylesterase 1 (S33 family)	0.0006	0.0171	0.0306
Schistosoma mansoni	Smad4	0.0008	0.0325	0.0583
Echinococcus multilocularis	abhydrolase domain containing protein 8	0.0006	0.0171	0.0306
Echinococcus multilocularis	Smad4	0.0008	0.0325	0.0583
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.1289	0.2308
Mycobacterium ulcerans	hypothetical protein	0.0006	0.0171	0.0279
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0252	0.0451
Brugia malayi	MH2 domain containing protein	0.0008	0.0325	0.0325
Mycobacterium tuberculosis	Unknown protein	0.0006	0.0171	0.0279
Onchocerca volvulus	Valacyclovir hydrolase homolog	0.0006	0.0171	0.0788
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0011	0.0619	0.1108
Brugia malayi	hypothetical protein	0.0025	0.1849	0.1849
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.1289	0.21
Schistosoma mansoni	ferritin	0.0008	0.0368	0.066
Mycobacterium leprae	PROBABLE LIPASE/ESTERASE LIPG	0.0006	0.0171	0.0646
Entamoeba histolytica	hypothetical protein	0.0035	0.2803	0.9339
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0038	0.3001	1
Mycobacterium ulcerans	bacterioferritin BfrB	0.0008	0.0368	0.0601
Echinococcus granulosus	smad	0.0008	0.0325	0.0583
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.1289	0.4293
Mycobacterium leprae	Possible membrane protein	0.0006	0.0171	0.0646
Mycobacterium ulcerans	lipase LipV	0.0006	0.0171	0.0279
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.1849	0.3313
Onchocerca volvulus		0.0028	0.2169	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0006	0.0171	0.0279
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.1849	0.3014
Toxoplasma gondii	hydrolase, alpha/beta fold family protein	0.0072	0.6136	1
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.3001	0.4892
Trypanosoma brucei	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.1849	0.3014
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Loa Loa (eye worm)	MH2 domain-containing protein	0.0115	1	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0006	0.0171	0.0279
Mycobacterium ulcerans	oxidoreductase	0.0006	0.0171	0.0279
Echinococcus multilocularis	cpg binding protein	0.003	0.2315	0.4146
Mycobacterium tuberculosis	Possible hydrolase	0.0006	0.0171	0.0279
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0407	0.0729
Mycobacterium tuberculosis	Probable haloalkane dehalogenase	0.0006	0.0171	0.0279
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0196	0.0653
Mycobacterium tuberculosis	Probable proline iminopeptidase Pip (prolyl aminopeptidase) (pap)	0.0006	0.0171	0.0279
Brugia malayi	CCG1-interacting factor B	0.0006	0.0171	0.0171
Mycobacterium tuberculosis	Unknown protein	0.0006	0.0171	0.0279
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.1289	0.2308
Schistosoma mansoni	cpg binding protein	0.003	0.2315	0.4146
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0252	0.0451
Loa Loa (eye worm)	hypothetical protein	0.0066	0.5583	0.5583
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Echinococcus granulosus	expressed protein	0.0008	0.0368	0.066
Trypanosoma brucei	Ankyrin repeats (many copies)/Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Possible hydrolase	0.0006	0.0171	0.0279
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.5029	0.9009
Giardia lamblia	Hypothetical protein	0.0006	0.0171	0.1327
Toxoplasma gondii	exonuclease III APE	0.0019	0.1289	0.21
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0407	0.0407
Mycobacterium tuberculosis	Probable lignin peroxidase LipJ	0.0006	0.0171	0.0279
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0038	0.3001	1
Echinococcus granulosus	protein phosphatase methylesterase 1	0.0006	0.0171	0.0306
Loa Loa (eye worm)	inositol-1	0.0038	0.3001	0.3001
Loa Loa (eye worm)	CCG1-interacting factor B	0.0006	0.0171	0.0171
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.2169	0.2169
Mycobacterium ulcerans	hydrolase	0.0006	0.0171	0.0279
Trypanosoma brucei	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0034	0.2647	1
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0325	0.0583
Toxoplasma gondii	hypothetical protein	0.0006	0.0171	0.0279
Loa Loa (eye worm)	nuclear factor I	0.0004	0.0009	0.0009
Trichomonas vaginalis	ferritin, putative	0.0008	0.0368	0.1228
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.1289	0.1289
Schistosoma mansoni	ferritin	0.0008	0.0368	0.066
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.3001	0.4892
Mycobacterium ulcerans	thioesterase	0.0006	0.0171	0.0279
Schistosoma mansoni	smad	0.0008	0.0325	0.0583
Mycobacterium tuberculosis	Possible lysophospholipase	0.0006	0.0171	0.0279
Echinococcus granulosus	abhydrolase domain containing protein 11	0.0066	0.5583	1
Leishmania major	hypothetical protein, conserved	0.0006	0.0171	0.0279
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.1289	0.21
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.1849	0.3313
Entamoeba histolytica	hypothetical protein	0.0035	0.2803	0.9339
Brugia malayi	hydrolase, alpha/beta fold family protein	0.0072	0.6136	0.6136
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.1289	0.21
Trypanosoma cruzi	hypothetical protein, conserved	0.0006	0.0171	0.0279
Schistosoma mansoni	hypothetical protein	0.0011	0.0619	0.1108
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.1289	0.4293
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Echinococcus multilocularis	inositol monophosphatase 1	0.0038	0.3001	0.5376
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Echinococcus multilocularis	protein phosphatase methylesterase 1	0.0006	0.0171	0.0306
Giardia lamblia	ENC6 protein	0.0006	0.0171	0.1327
Mycobacterium ulcerans	bacterioferritin BfrA	0.0008	0.0368	0.0601
Brugia malayi	MH2 domain containing protein	0.0008	0.0325	0.0325
Echinococcus multilocularis	abhydrolase domain containing protein 13	0.0006	0.0171	0.0306
Schistosoma mansoni	inositol monophosphatase	0.0038	0.3001	0.5376
Echinococcus granulosus	maspardin	0.0006	0.0171	0.0306
Echinococcus multilocularis	ferritin	0.0008	0.0368	0.066
Mycobacterium ulcerans	hypothetical protein	0.0006	0.0171	0.0279
Schistosoma mansoni	ferritin	0.0008	0.0368	0.066
Mycobacterium ulcerans	hydrolase	0.0006	0.0171	0.0279
Leishmania major	hypothetical protein, conserved	0.0006	0.0171	0.0279
Schistosoma mansoni	ferritin light chain	0.0008	0.0368	0.066
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0325	0.0583
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0252	0.0451
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.1289	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.1849	0.3313
Loa Loa (eye worm)	hypothetical protein	0.0025	0.1849	0.1849
Trypanosoma brucei	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Entamoeba histolytica	hypothetical protein	0.0035	0.2803	0.9339
Mycobacterium tuberculosis	Probable epoxide hydrolase EphC (epoxide hydratase)	0.0006	0.0171	0.0279
Onchocerca volvulus		0.0006	0.0171	0.0788
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.3001	0.4892
Brugia malayi	Smad1	0.0008	0.0325	0.0325
Schistosoma mansoni	ferritin light chain	0.0008	0.0368	0.066
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0325	0.0583
Loa Loa (eye worm)	protein phosphatase methylesterase 1	0.0006	0.0171	0.0171
Toxoplasma gondii	hypothetical protein	0.0006	0.0171	0.0279
Trichomonas vaginalis	inositol monophosphatase, putative	0.0038	0.3001	1
Echinococcus granulosus	abhydrolase domain containing protein 8	0.0006	0.0171	0.0306
Toxoplasma gondii	hydrolase, alpha/beta fold family protein	0.0006	0.0171	0.0279
Wolbachia endosymbiont of Brugia malayi	bacterioferritin/cytochrome b1	0.0008	0.0368	0.1228
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0325	0.0583
Brugia malayi	protein phosphatase methylesterase 1	0.0006	0.0171	0.0171
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Treponema pallidum	bacterioferrin (TpF1)	0.0008	0.0368	0.1767
Schistosoma mansoni	cpg binding protein	0.003	0.2315	0.4146
Loa Loa (eye worm)	hypothetical protein	0.0004	0.0009	0.0009
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0325	0.0583
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0252	0.0451
Mycobacterium leprae	PROBABLE BACTERIOFERRITIN BFRA	0.0008	0.0368	0.1392
Loa Loa (eye worm)	transcription factor SMAD2	0.0115	1	1
Mycobacterium tuberculosis	Unknown protein	0.0006	0.0171	0.0279
Schistosoma mansoni	apoferritin-2	0.0008	0.0368	0.066
Trichomonas vaginalis	helicase, putative	0.0006	0.0196	0.0653
Brugia malayi	MH1 domain containing protein	0.0004	0.0009	0.0009
Brugia malayi	hypothetical protein	0.0035	0.2803	0.2803
Brugia malayi	Inositol-1	0.0038	0.3001	0.3001
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Schistosoma mansoni	inositol monophosphatase	0.0038	0.3001	0.5376
Leishmania major	hypothetical protein, conserved	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Conserved protein	0.0006	0.0171	0.0279
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0038	0.3001	0.4892
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Schistosoma mansoni	family S33 non-peptidase homologue (S33 family)	0.0066	0.5583	1
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0038	0.3001	0.4892
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.1289	0.4293
Toxoplasma gondii	hypothetical protein	0.0006	0.0171	0.0279
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0325	0.0325
Giardia lamblia	Hypothetical protein	0.0006	0.0171	0.1327
Mycobacterium tuberculosis	Probable epoxide hydrolase EphB (epoxide hydratase)	0.0006	0.0171	0.0279
Mycobacterium leprae	POSSIBLE LYSOPHOSPHOLIPASE	0.0006	0.0171	0.0646
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0066	0.5583	1
Mycobacterium ulcerans	hypothetical protein	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Conserved protein	0.0006	0.0171	0.0279
Brugia malayi	CXXC zinc finger family protein	0.0028	0.2169	0.2169
Schistosoma mansoni	cpg binding protein	0.0028	0.2169	0.3886
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0196	0.0653
Toxoplasma gondii	chain a, pp2a-specific methylesterase apo form (pme), putative	0.0006	0.0171	0.0279
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0252	0.0451
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.1289	0.4293
Brugia malayi	hypothetical protein	0.0016	0.1059	0.1059
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	0.0072	0.6136	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0407	0.0729
Echinococcus multilocularis	expressed protein	0.0008	0.0368	0.066
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0325	0.0583
Onchocerca volvulus	Putative protein phosphatase methylesterase 1	0.0006	0.0171	0.0788
Mycobacterium leprae	POSSIBLE HYDROLASE	0.0006	0.0171	0.0646
Mycobacterium leprae	Possible hydrolase	0.0006	0.0171	0.0646
Mycobacterium tuberculosis	Probable hydrolase	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Probable lipase/esterase LipG	0.0006	0.0171	0.0279
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.3001	0.4892
Mycobacterium tuberculosis	Conserved hypothetical alanine rich protein	0.0006	0.0171	0.0279
Giardia lamblia	Protein phosphatase methylesterase-1	0.0006	0.0171	0.1327
Echinococcus granulosus	ferritin	0.0008	0.0368	0.066
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0006	0.0171	0.057
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Probable epoxide hydrolase MesT (epoxide hydratase) (arene-oxide hydratase)	0.0006	0.0171	0.0279
Plasmodium vivax	alpha/beta hydrolase, putative	0.0066	0.5583	1
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.3001	1
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.2803	0.5021
Brugia malayi	MH1 domain containing protein	0.0008	0.0325	0.0325
Trypanosoma brucei	Alpha/beta hydrolase family, putative	0.0072	0.6136	1
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0054	0.4451	0.7255
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.2803	0.5021
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0196	0.0653
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.1289	0.1289
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.1289	0.2308
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.1289	0.21
Leishmania major	hypothetical protein, conserved	0.0025	0.1849	0.3014
Schistosoma mansoni	apoferritin-2	0.0008	0.0368	0.066
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.1849	0.3014
Schistosoma mansoni	ferritin	0.0008	0.0368	0.066
Mycobacterium ulcerans	hydrolase	0.0006	0.0171	0.0279
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0325	0.0583
Echinococcus multilocularis	smad	0.0008	0.0325	0.0583
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.3001	1
Entamoeba histolytica	hypothetical protein	0.0035	0.2803	0.9339
Trypanosoma cruzi	Alpha/beta hydrolase family, putative	0.0006	0.0171	0.0279
Echinococcus multilocularis	maspardin	0.0006	0.0171	0.0306
Onchocerca volvulus		0.0006	0.0171	0.0788
Echinococcus multilocularis	abhydrolase domain containing protein 11	0.0066	0.5583	1
Mycobacterium tuberculosis	Possible lipase LipV	0.0006	0.0171	0.0279
Mycobacterium ulcerans	lysophospholipase	0.0006	0.0171	0.0279
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.1849	0.3014
Loa Loa (eye worm)	Smad1	0.0008	0.0325	0.0325
Mycobacterium tuberculosis	Probable bacterioferritin BfrA	0.0008	0.0368	0.0601
Leishmania major	hypothetical protein, conserved	0.0072	0.6136	1
Brugia malayi	MH1 domain containing protein	0.0008	0.0325	0.0325
Onchocerca volvulus	Alpha\/beta hydrolase2 homolog	0.0006	0.0171	0.0788
Schistosoma mansoni	ap endonuclease	0.0019	0.1289	0.2308
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0196	0.0653
Mycobacterium ulcerans	epoxide hydrolase EphC	0.0006	0.0171	0.0279
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0006	0.0171	0.0279
Schistosoma mansoni	ap endonuclease	0.0019	0.1289	0.2308
Mycobacterium ulcerans	hypothetical protein	0.0006	0.0171	0.0279

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	0.000137 uM	PUBCHEM_BIOASSAY: Late stage assay provider results from the probe development effort to identify inhibitors of LYPLA1: fluorescence-based cell-based gel-based Activity-Based Protein Profiling (ABPP) IC50 for anti-target ABHD11. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2174, AID2177, AID2202, AID2203, AID2232, AID2233, AID493105, AID493108, AID493109, AID493110, AID493111, AID493154, AID493161, AID504892]	ChEMBL.	No reference
IC50 (binding)	0.001 uM	PUBCHEM_BIOASSAY: Late stage assay provider results from the probe development effort to identify inhibitors of LYPLA1: fluorescence-based biochemical gel-based Activity-Based Protein Profiling (ABPP) IC50 for anti-target ABHD11 Set 2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2174, AID2177, AID2202, AID2203, AID2232, AID2233, AID493105, AID493108, AID493109, AID493110, AID493111, AID493154, AID493161, AID504892]	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: CHEMBL1869321

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1117406