TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 488.258 | Formula: C23H24Br2N2
H donors: 0 H acceptors: 0 LogP: 7.29 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: C(CC[n+]1cccc2c1cccc2)CC[n+]1cccc2c1cccc2.[Br-].[Br-]
InChi: 1S/C23H24N2.2BrH/c1(6-16-24-18-8-12-20-10-2-4-14-22(20)24)7-17-25-19-9-13-21-11-3-5-15-23(21)25;;/h2-5,8-15,18-19H,1,6-7,16-17H2;2*1H/q+2;;/p-2
InChiKey: CTCVESFARVIVOE-UHFFFAOYSA-L

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	acetylcholinesterase (Yt blood group)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	Acetylcholinesterase 1 precursor, putative	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	carboxylesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Loa Loa (eye worm)	acetylcholinesterase 1	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	carboxylesterase 5A	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Brugia malayi	Carboxylesterase family protein	Get druggable targets OG5_126875	All targets in OG5_126875
Schistosoma japonicum	ko:K01049 acetylcholinesterase [EC3.1.1.7], putative	Get druggable targets OG5_126875	All targets in OG5_126875

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Carboxylesterase family protein	acetylcholinesterase (Yt blood group)	614 aa	510 aa	26.5 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.001	0.0073	0.0073
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Brugia malayi	hypothetical protein	0.0063	0.1198	0.2818
Echinococcus granulosus	histone acetyltransferase MYST2	0.0054	0.0999	0.1143
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0028	0.0449	0.044
Echinococcus multilocularis	neuroligin	0.0028	0.0449	0.044
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0234	0.1891
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0359	0.035
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0501	0.0568
Echinococcus granulosus	BC026374 protein S09 family	0.0028	0.0449	0.0508
Loa Loa (eye worm)	hypothetical protein	0.003	0.0501	0.1165
Schistosoma mansoni	apoferritin-2	0.0008	0.0041	0.0032
Mycobacterium ulcerans	dehydrogenase	0.0063	0.1198	0.1189
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0359	0.083
Brugia malayi	Pre-SET motif family protein	0.003	0.0501	0.1165
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0636	0.5271
Onchocerca volvulus		0.0023	0.0359	0.0726
Echinococcus multilocularis	expressed protein	0.0008	0.0041	0.0032
Loa Loa (eye worm)	carboxylesterase	0.0164	0.3326	0.7867
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.0359	0.5587
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0054	0.0999	0.2346
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0008	0.0036	0.0027
Brugia malayi	mbt repeat family protein	0.0047	0.0861	0.2019
Mycobacterium ulcerans	bacterioferritin BfrB	0.0008	0.0041	0.0032
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.3326	0.332
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0063	0.1198	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0234	0.0533
Mycobacterium tuberculosis	Probable protoporphyrinogen oxidase HemY (protoporphyrinogen-IX oxidase) (protoporphyrinogenase) (PPO)	0.0416	0.8666	1
Schistosoma mansoni	cpg binding protein	0.003	0.0498	0.0489
Plasmodium vivax	SET domain protein, putative	0.003	0.0501	0.4135
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0464	0.1078
Echinococcus granulosus	cpg binding protein	0.003	0.0498	0.0565
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0033	0.0555	0.0546
Brugia malayi	amine oxidase, flavin-containing family protein	0.0063	0.1198	0.2818
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0359	0.083
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0008	0.0036	0.0027
Echinococcus multilocularis	para nitrobenzyl esterase	0.0028	0.0449	0.044
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0501	0.0492
Treponema pallidum	bacterioferrin (TpF1)	0.0008	0.0041	0.5
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0359	0.2945
Echinococcus granulosus	acetylcholinesterase	0.0164	0.3326	0.3831
Schistosoma mansoni	ferritin light chain	0.0008	0.0041	0.0032
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0501	0.0492
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0501	0.0492
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0063	0.1198	1
Loa Loa (eye worm)	carboxylesterase	0.0028	0.0449	0.1043
Schistosoma mansoni	acetylcholinesterase	0.0028	0.0449	0.044
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0359	0.5587
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0063	0.1198	0.1373
Toxoplasma gondii	histone lysine-specific demethylase	0.0063	0.1198	0.9701
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.0449	0.0508
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0464	0.1078
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0359	0.035
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0359	0.035
Trichomonas vaginalis	spcc417.12 protein, putative	0.0028	0.0449	0.093
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0636	1
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0636	0.1317
Schistosoma mansoni	cpg binding protein	0.003	0.0498	0.0489
Schistosoma mansoni	ferritin	0.0008	0.0041	0.0032
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0054	0.0999	0.099
Schistosoma mansoni	hypothetical protein	0.0286	0.5923	0.5919
Onchocerca volvulus		0.0047	0.0861	0.1767
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0359	0.035
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0008	0.0036	0.0031
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0063	0.1198	1
Onchocerca volvulus		0.0063	0.1198	0.2467
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0234	0.0533
Echinococcus multilocularis	geminin	0.0167	0.3405	0.3398
Brugia malayi	Carboxylesterase family protein	0.0028	0.0449	0.1043
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0359	0.0404
Brugia malayi	Inositol-1	0.0036	0.0636	0.1485
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0009	0.002
Schistosoma mansoni	BC026374 protein (S09 family)	0.0028	0.0449	0.044
Loa Loa (eye worm)	MBCTL1	0.0054	0.0999	0.2346
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0234	0.026
Loa Loa (eye worm)	acetylcholinesterase 1	0.0164	0.3326	0.7867
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0186	0.3792	0.3786
Schistosoma mansoni	gliotactin	0.0028	0.0449	0.044
Echinococcus granulosus	carboxylesterase 5A	0.0164	0.3326	0.3831
Echinococcus multilocularis	ferritin	0.0008	0.0041	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3326	0.7867
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0234	0.1891
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0449	0.044
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0359	0.035
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0054	0.0999	0.099
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0359	0.083
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0054	0.0999	0.1143
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0359	0.035
Schistosoma mansoni	hypothetical protein	0.0404	0.841	0.8409
Onchocerca volvulus		0.0028	0.0449	0.0912
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0636	0.5271
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0636	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0359	0.083
Schistosoma mansoni	hypothetical protein	0.0167	0.3405	0.3398
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0359	0.035
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0359	0.0404
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0063	0.1198	0.1189
Echinococcus granulosus	acetylcholinesterase	0.0164	0.3326	0.3831
Onchocerca volvulus		0.0028	0.0464	0.0944
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0501	0.0492
Onchocerca volvulus		0.0028	0.0449	0.0912
Echinococcus granulosus	para nitrobenzyl esterase	0.0028	0.0449	0.0508
Mycobacterium tuberculosis	Possible oxidoreductase	0.0063	0.1198	0.1373
Onchocerca volvulus		0.0028	0.0449	0.0912
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0063	0.1198	1
Echinococcus multilocularis	polycomb protein SCMH1	0.0047	0.0861	0.0852
Loa Loa (eye worm)	mbt repeat family protein	0.0047	0.0861	0.2019
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0047	0.0861	0.1767
Trichomonas vaginalis	ferritin, putative	0.0008	0.0041	0.0085
Brugia malayi	Carboxylesterase family protein	0.0164	0.3326	0.7867
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0063	0.1198	0.1189
Echinococcus granulosus	dnaJ subfamily B	0.0404	0.841	0.9704
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0449	0.044
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0063	0.1198	0.1189
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0186	0.3792	0.4369
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0234	0.0533
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Onchocerca volvulus		0.0028	0.0449	0.0912
Echinococcus multilocularis	cpg binding protein	0.003	0.0498	0.0489
Schistosoma mansoni	ferritin	0.0008	0.0041	0.0032
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0214	0.0236
Trichomonas vaginalis	antibiotic synthetase, putative	0.0007	0.0009	0.002
Schistosoma mansoni	cpg binding protein	0.0028	0.0464	0.0455
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0359	0.035
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0359	0.2945
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0234	0.0533
Plasmodium vivax	hypothetical protein, conserved	0.0063	0.1198	1
Loa Loa (eye worm)	inositol-1	0.0036	0.0636	0.1485
Onchocerca volvulus		0.0235	0.4826	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0028	0.0449	0.044
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0028	0.0449	0.0508
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0065	0.1234	1
Brugia malayi	Pre-SET motif family protein	0.0206	0.4226	1
Mycobacterium tuberculosis	Bacterioferritin BfrB	0.0008	0.0041	0.0037
Schistosoma mansoni	amine oxidase	0.0063	0.1198	0.1189
Echinococcus multilocularis	dnaJ subfamily B	0.0404	0.841	0.8409
Schistosoma mansoni	apoferritin-2	0.0008	0.0041	0.0032
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0636	0.1317
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.0636	0.5113
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0008	0.0036	0.0031
Mycobacterium ulcerans	oxidoreductase	0.0063	0.1198	0.1189
Brugia malayi	SWIRM domain containing protein	0.0063	0.1198	0.2818
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.0636	1
Brugia malayi	mbt repeat family protein	0.0047	0.0861	0.2019
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0861	0.0852
Schistosoma mansoni	ferritin	0.0008	0.0041	0.0032
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0055	0.1024	0.8282
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0063	0.1198	0.1189
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0018	0.0234	0.0225
Leishmania major	UDP-galactopyranose mutase	0.0063	0.1198	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0359	0.035
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0465	0.0526
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0861	0.2019
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0636	0.0627
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0636	0.0627
Plasmodium vivax	hypothetical protein, conserved	0.0063	0.1198	1
Schistosoma mansoni	ferritin light chain	0.0008	0.0041	0.0032
Mycobacterium ulcerans	monoamine oxidase	0.0063	0.1198	0.1189
Mycobacterium ulcerans	carboxylesterase, LipT	0.0028	0.0449	0.044
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0449	0.044
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0861	0.0852
Plasmodium falciparum	protoporphyrinogen oxidase	0.0063	0.1198	1
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0047	0.0861	0.0852
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0359	0.083
Onchocerca volvulus		0.003	0.0501	0.102
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0028	0.0449	0.093
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0028	0.0449	0.0508
Brugia malayi	Carboxylesterase family protein	0.0028	0.0449	0.1043
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0047	0.0861	0.0852
Echinococcus granulosus	expressed protein	0.0008	0.0041	0.0037
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0636	0.0627
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0501	0.0492
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0359	0.035
Echinococcus granulosus	ferritin	0.0008	0.0041	0.0037
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0636	0.0627
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0636	0.1317
Echinococcus granulosus	polycomb protein SCMH1	0.0047	0.0861	0.0983
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0164	0.3326	0.332
Loa Loa (eye worm)	histone methyltransferase	0.001	0.0073	0.015
Echinococcus granulosus	geminin	0.0167	0.3405	0.3922
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0636	0.5271
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0359	0.5587
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0449	0.1043
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Brugia malayi	Carboxylesterase family protein	0.0028	0.0449	0.1043
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0061	0.116	0.1151
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0359	0.083
Onchocerca volvulus		0.0028	0.0449	0.0912
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0214	0.0236
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.0636	0.0723
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0214	0.0236
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0063	0.1198	0.1373
Echinococcus granulosus	neuroligin	0.0028	0.0449	0.0508
Loa Loa (eye worm)	carboxylesterase	0.0028	0.0449	0.1043
Loa Loa (eye worm)	hypothetical protein	0.0063	0.1198	0.2818
Echinococcus granulosus	protoporphyrinogen oxidase	0.0416	0.8666	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0008	0.0036	0.0027
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0214	0.0236
Brugia malayi	Carboxylesterase family protein	0.0164	0.3326	0.7867
Trichomonas vaginalis	set domain proteins, putative	0.0235	0.4826	1
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0063	0.1198	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0359	0.2945
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0999	0.2346
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0206	0.4226	1
Echinococcus multilocularis		0.0063	0.1198	0.1189
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0063	0.1198	1
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0054	0.0999	0.099
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.001	0.0073	0.0063
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0234	0.0533
Schistosoma mansoni	hypothetical protein	0.0167	0.3405	0.3398
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0028	0.0449	0.044
Brugia malayi	Carboxylesterase family protein	0.0028	0.0449	0.1043
Loa Loa (eye worm)	hypothetical protein	0.0164	0.3326	0.7867
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0501	0.4012
Echinococcus granulosus	SAM and MBT domain containing protein	0.0047	0.0861	0.0983
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0033	0.0555	0.063
Mycobacterium tuberculosis	Probable bacterioferritin BfrA	0.0008	0.0041	0.0037
Schistosoma mansoni	amine oxidase	0.0063	0.1198	0.1189
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0501	0.0492
Brugia malayi	F/Y-rich N-terminus family protein	0.001	0.007	0.0144
Brugia malayi	hypothetical protein	0.0028	0.0449	0.1043
Mycobacterium leprae	PROBABLE BACTERIOFERRITIN BFRA	0.0008	0.0041	0.0032
Schistosoma mansoni	ferritin	0.0008	0.0041	0.0032
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0063	0.1198	0.1373
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.3326	0.332
Mycobacterium ulcerans	bacterioferritin BfrA	0.0008	0.0041	0.0032
Echinococcus multilocularis	carboxylesterase 5A	0.0164	0.3326	0.332
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.0449	0.0508

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 4 uM	Inhibition of human erythrocyte recombinant AChE by modified Ellman's method	ChEMBL.	21397501
IC50 (binding)	= 34 uM	Inhibition of human plasmatic BChE by modified Ellman's method	ChEMBL.	21397501

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

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

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External resources for this compound

ChEMBL: CHEMBL1761993

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1511885