TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 377.479 | Formula: C23H27N3O2
H donors: 2 H acceptors: 2 LogP: 4.28 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)C1=C(C)Nc2c([C@H]1c1ccc(cc1)C)c(N)c1c(n2)CCCC1
InChi: 1S/C23H27N3O2/c1-4-28-23(27)18-14(3)25-22-20(19(18)15-11-9-13(2)10-12-15)21(24)16-7-5-6-8-17(16)26-22/h9-12,19H,4-8H2,1-3H3,(H3,24,25,26)/t19-/m0/s1
InChiKey: QTVIWMLMXFVZIY-IBGZPJMESA-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	acetylcholinesterase (Yt blood group)	Starlite/ChEMBL	No 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
Echinococcus granulosus	acetylcholinesterase	Get druggable targets OG5_126875	All targets in OG5_126875
Echinococcus multilocularis	carboxylesterase 5A	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
Loa Loa (eye worm)	acetylcholinesterase 1	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
Echinococcus granulosus	carboxylesterase 5A	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)	carboxylesterase	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

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
Onchocerca volvulus		0.0028	0.0099	0.0497
Brugia malayi	RNA recognition motif domain containing protein	0.0062	0.0363	0.0357
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0078	0.0195
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0256	0.1877	0.1877
Schistosoma mansoni	hypothetical protein	0.0112	0.0754	0.0754
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0145	0.0145
Entamoeba histolytica	hypothetical protein	0.0138	0.0958	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0037	0.0175	0.0168
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0256	0.1877	0.1872
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0085	0.0547	0.8796
Echinococcus multilocularis	neuroligin	0.0028	0.0099	0.0093
Brugia malayi	hypothetical protein	0.0016	0.0009	0.0003
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0118	0.0803	0.0803
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.043	0.3228	0.3224
Schistosoma mansoni	serine/threonine protein kinase	0.0279	0.2058	0.2058
Onchocerca volvulus		0.0028	0.0099	0.0497
Brugia malayi	hypothetical protein	0.0118	0.0803	0.0798
Onchocerca volvulus		0.0118	0.0803	0.4261
Brugia malayi	hypothetical protein	0.0118	0.0803	0.0798
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0047	0.0246	0.024
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0246	0.024
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0047	0.0246	0.0654
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0145	0.0139
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0193	0.1385	0.3762
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0046	0.0246	0.024
Echinococcus granulosus	nAChR subunit	0.0256	0.1877	0.1872
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0034	0.0145	0.1679
Brugia malayi	glutathione reductase	0.0037	0.0175	0.0168
Toxoplasma gondii	facilitative glucose transporter GT1	0.0112	0.0754	0.0748
Schistosoma mansoni	sugar transporter	0.0016	0.0006	0.0006
Trichomonas vaginalis	spcc417.12 protein, putative	0.0028	0.0099	0.0093
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.13	1	1
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0118	0.0803	0.0798
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0138	0.0958	0.0952
Loa Loa (eye worm)	ACC-1 protein	0.0256	0.1877	0.1872
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.13	1	1
Trichomonas vaginalis	CMGC family protein kinase	0.13	1	1
Loa Loa (eye worm)	acetylcholine receptor protein	0.0118	0.0803	0.0798
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0363	0.0363
Toxoplasma gondii	thioredoxin reductase	0.0037	0.0175	0.0168
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0138	0.0958	0.0958
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0099	0.0099
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0256	0.1877	0.1872
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0025	0.0078	0.7723
Echinococcus multilocularis	glycine receptor subunit beta	0.0256	0.1877	0.1872
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0118	0.0803	0.0798
Trichomonas vaginalis	CAMK family protein kinase	0.0046	0.0246	0.024
Echinococcus granulosus	mitogen activated protein kinase	0.13	1	1
Giardia lamblia	Lysyl-tRNA synthetase	0.0025	0.0078	0.0072
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Brugia malayi	Thioredoxin reductase	0.0037	0.0175	0.0168
Echinococcus multilocularis	para nitrobenzyl esterase	0.0028	0.0099	0.0093
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0154	0.0148
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0085	0.0547	0.8707
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0256	0.1877	0.1872
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0039	0.0188	0.0182
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0034	0.0145	0.0759
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Trypanosoma brucei	glucose transporter 1E	0.0035	0.0154	0.0148
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0256	0.1877	0.1872
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0256	0.1877	0.1872
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0363	0.0363
Loa Loa (eye worm)	carboxylesterase	0.0028	0.0099	0.0093
Echinococcus granulosus	acetylcholinesterase	0.0164	0.1158	0.1153
Echinococcus multilocularis	carboxylesterase 5A	0.0164	0.1158	0.1153
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0138	0.0958	0.0958
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0085	0.0547	0.8796
Brugia malayi	Carboxylesterase family protein	0.0028	0.0099	0.0093
Schistosoma mansoni	gliotactin	0.0028	0.0099	0.0099
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Leishmania major	glucose transporter, lmgt2	0.0035	0.0154	0.0148
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0095	0.0621	1
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0118	0.0803	0.0798
Echinococcus multilocularis	nAChR subunit	0.0138	0.0958	0.0952
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0028	0.0099	0.0093
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0034	0.0145	0.0139
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0085	0.0547	0.8796
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Plasmodium falciparum	thioredoxin reductase	0.0037	0.0175	0.0459
Leishmania major	hypothetical protein, conserved	0.0025	0.0078	0.0071
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0154	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Brugia malayi	excitatory GABA receptor EXP-1A	0.0256	0.1877	0.1872
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0095	0.0621	1
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0256	0.1877	0.1872
Schistosoma mansoni	neurotransmitter gated ion channel	0.0118	0.0803	0.0803
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0256	0.1877	0.1877
Giardia lamblia	Kinase, CMGC MAPK	0.13	1	1
Schistosoma mansoni	glucose transport protein	0.0112	0.0754	0.0754
Schistosoma mansoni	sugar transporter	0.0016	0.0006	0.0006
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0022	0.0054	0.0048
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0028	0.0099	0.1514
Onchocerca volvulus		0.0028	0.0099	0.0497
Brugia malayi	lysyl-tRNA synthetase	0.0025	0.0078	0.0072
Trypanosoma brucei	trypanothione reductase	0.0037	0.0175	0.0168
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0256	0.1877	0.1872
Echinococcus granulosus	calcium dependent protein kinase	0.0032	0.0134	0.0128
Brugia malayi	RNA binding protein	0.0062	0.0363	0.0357
Schistosoma mansoni	BC026374 protein (S09 family)	0.0028	0.0099	0.0099
Trichomonas vaginalis	CMGC family protein kinase	0.13	1	1
Brugia malayi	Carboxylesterase family protein	0.0028	0.0099	0.0093
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0256	0.1877	0.1872
Brugia malayi	Cytochrome P450 family protein	0.0025	0.0082	0.0075
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0256	0.1877	0.1872
Schistosoma mansoni	nAChR subunit	0.0118	0.0803	0.0803
Echinococcus granulosus	nAChR subunit	0.0138	0.0958	0.0952
Brugia malayi	hypothetical protein	0.0118	0.0803	0.0798
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Plasmodium vivax	glutathione reductase, putative	0.0037	0.0175	0.0459
Mycobacterium tuberculosis	Probable oxidoreductase	0.0095	0.0621	1
Trichomonas vaginalis	glucose transporter, putative	0.0035	0.0154	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0047	0.0246	0.0654
Leishmania major	protein kinase, putative	0.0046	0.0246	0.024
Leishmania major	lysyl-tRNA synthetase, putative	0.0025	0.0078	0.0072
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0078	0.0071
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0085	0.0547	0.8796
Echinococcus multilocularis	calcium dependent protein kinase	0.0032	0.0134	0.0128
Plasmodium falciparum	lysine--tRNA ligase	0.0025	0.0078	0.0196
Loa Loa (eye worm)	hypothetical protein	0.043	0.3228	0.3224
Echinococcus granulosus	BC026374 protein S09 family	0.0028	0.0099	0.0093
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0145	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0078	0.0071
Plasmodium vivax	thioredoxin reductase, putative	0.0037	0.0175	0.0459
Loa Loa (eye worm)	glutathione reductase	0.0037	0.0175	0.0168
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0256	0.1877	0.1872
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0154	0.0148
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0256	0.1877	0.1877
Loa Loa (eye worm)	acetylcholinesterase 1	0.0164	0.1158	0.1153
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0025	0.0078	0.7723
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0118	0.0803	0.0798
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.13	1	1
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0039	0.0188	0.0182
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Plasmodium falciparum	protein kinase 6	0.0487	0.3671	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.13	1	1
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0046	0.0246	0.024
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0078	0.0071
Schistosoma mansoni	protein kinase	0.0046	0.0246	0.0246
Echinococcus granulosus	tar DNA binding protein	0.0062	0.0363	0.0357
Brugia malayi	Carboxylesterase family protein	0.0028	0.0099	0.0093
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0095	0.0621	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Onchocerca volvulus	Putative nachr subunit	0.0256	0.1877	1
Schistosoma mansoni	acetylcholinesterase	0.0028	0.0099	0.0099
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.0099	0.1514
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Echinococcus multilocularis	General substrate transporter	0.0096	0.0631	0.0626
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Onchocerca volvulus		0.0118	0.0803	0.4261
Entamoeba histolytica	protein kinase, putative	0.0046	0.0246	0.1906
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0078	0.0071
Plasmodium falciparum	glutathione reductase	0.0037	0.0175	0.0459
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0039	0.0188	0.0182
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0803	0.0798
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.13	1	1
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0034	0.0145	0.0139
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Trichomonas vaginalis	glucose transporter, putative	0.0035	0.0154	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Brugia malayi	Cam kinase protein 1	0.0046	0.0246	0.024
Trypanosoma cruzi	hexose transporter, putative	0.0019	0.0031	0.0025
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0099	0.0099
Onchocerca volvulus		0.0256	0.1877	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0256	0.1877	0.1872
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0021	0.0049	0.0693
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0363	0.0363
Loa Loa (eye worm)	carboxylesterase	0.0164	0.1158	0.1153
Echinococcus multilocularis	glycine receptor subunit beta	0.0256	0.1877	0.1872
Schistosoma mansoni	glucose transport protein	0.0112	0.0754	0.0754
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0154	0.0148
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0256	0.1877	0.1872
Brugia malayi	Carboxylesterase family protein	0.0028	0.0099	0.0093
Echinococcus multilocularis	nAChR subunit	0.0256	0.1877	0.1872
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0021	0.0049	0.0693
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0078	0.0072
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0193	0.1385	0.1379
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0256	0.1877	0.1872
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0039	0.0188	0.0182
Brugia malayi	hypothetical protein	0.0118	0.0803	0.0798
Echinococcus granulosus	acetylcholinesterase	0.0164	0.1158	0.1153
Echinococcus granulosus	mitogen activated protein kinase 3	0.13	1	1
Echinococcus granulosus	glycine receptor subunit beta	0.0256	0.1877	0.1872
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Schistosoma mansoni	serine/threonine protein kinase	0.13	1	1
Trypanosoma brucei	glucose transporter 2A	0.0035	0.0154	0.0148
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Chlamydia trachomatis	lysine--tRNA ligase	0.0025	0.0078	0.5
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0256	0.1877	0.1877
Brugia malayi	hypothetical protein	0.0118	0.0803	0.0798
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0138	0.0958	0.0952
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.13	1	1
Loa Loa (eye worm)	hypothetical protein	0.0312	0.2309	0.2304
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0025	0.0078	0.0072
Onchocerca volvulus		0.0138	0.0958	0.5086
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0487	0.3671	1
Echinococcus granulosus	General substrate transporter	0.0096	0.0631	0.0626
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0025	0.0078	0.0072
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0047	0.0246	0.0654
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0138	0.0958	0.0952
Schistosoma mansoni	glucose transporter	0.0016	0.0006	0.0006
Schistosoma mansoni	sugar transporter	0.0016	0.0006	0.0006
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Brugia malayi	Cation transporter family protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Onchocerca volvulus		0.0256	0.1877	1
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0154	0.0148
Echinococcus multilocularis	c Jun NH2 terminal kinase	0.0279	0.2058	0.2053
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0037	0.0175	0.2739
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0034	0.0145	0.0139
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0256	0.1877	0.1872
Brugia malayi	Carboxylesterase family protein	0.0164	0.1158	0.1153
Schistosoma mansoni	serine/threonine protein kinase	0.0046	0.0246	0.0246
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0193	0.1385	0.3762
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0256	0.1877	0.1872
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0256	0.1877	0.1872
Onchocerca volvulus		0.0256	0.1877	1
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0154	0.0148
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0145	0.0139
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0046	0.0246	0.024
Loa Loa (eye worm)	CMGC/MAPK/JNK protein kinase	0.0279	0.2058	0.2053
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0256	0.1877	0.1872
Loa Loa (eye worm)	LGC-31 protein	0.0256	0.1877	0.1872
Plasmodium vivax	lysine--tRNA ligase, putative	0.0025	0.0078	0.0196
Mycobacterium tuberculosis	Probable reductase	0.0085	0.0547	0.8796
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Plasmodium falciparum	hexose transporter	0.0112	0.0754	0.204
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0028	0.0099	0.0099
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0118	0.0803	0.0798
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.13	1	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1158	0.1153
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Schistosoma mansoni	lysyl-tRNA synthetase	0.0025	0.0078	0.0078
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0256	0.1877	0.1872
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0039	0.0188	0.0182
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0118	0.0803	0.0798
Brugia malayi	hypothetical protein	0.0025	0.0078	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Onchocerca volvulus		0.0118	0.0803	0.4261
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0256	0.1877	0.1872
Loa Loa (eye worm)	ACC-1 protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Plasmodium falciparum	protein kinase 7	0.0328	0.2437	0.6632
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0047	0.0246	0.0654
Loa Loa (eye worm)	carboxylesterase	0.0028	0.0099	0.0093
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0803	0.0798
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Plasmodium vivax	hexose transporter	0.0112	0.0754	0.204
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0028	0.0099	0.1514
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.0179	0.0172
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0256	0.1877	0.1872
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0028	0.0099	0.0093
Echinococcus granulosus	carboxylesterase 5A	0.0164	0.1158	0.1153
Leishmania major	trypanothione reductase	0.0037	0.0175	0.0168
Schistosoma mansoni	acetylcholine receptor-related	0.0118	0.0803	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0047	0.0246	0.0654
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0145	0.0139
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0363	0.0363
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.0179	0.0172
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0096	0.009
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0078	0.0071
Trichomonas vaginalis	CMGC family protein kinase	0.13	1	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0118	0.0803	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0256	0.1877	0.1872
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0016	0.0006	0.5
Brugia malayi	Stress-activated protein kinase jnk-1	0.0279	0.2058	0.2053
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.1158	0.1153
Trichomonas vaginalis	CMGC family protein kinase	0.13	1	1
Leishmania major	glucose transporter, lmgt3	0.0035	0.0154	0.0148
Loa Loa (eye worm)	TAR-binding protein	0.0062	0.0363	0.0357
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Schistosoma mansoni	nAChR subunit	0.0118	0.0803	0.0803
Echinococcus multilocularis	mitogen activated protein kinase 3	0.13	1	1
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0047	0.0246	0.0654
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0154	0.0148
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	0.0363	0.0357
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0028	0.0099	0.0099
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0025	0.0078	0.0512
Brugia malayi	Carboxylesterase family protein	0.0164	0.1158	0.1153
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.0363	0.0363
Plasmodium falciparum	proline--tRNA ligase	0.0039	0.0188	0.0496
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0256	0.1877	0.1872
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0035	0.0154	0.0148
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0039	0.0188	0.0182
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0164	0.1158	0.1158
Loa Loa (eye worm)	GABA receptor subunit	0.0138	0.0958	0.0952
Brugia malayi	Cation transporter family protein	0.0256	0.1877	0.1872
Plasmodium vivax	proline--tRNA ligase, putative	0.0039	0.0188	0.0496
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0138	0.0958	0.0952
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0154	0.0148
Trichomonas vaginalis	conserved hypothetical protein	0.0112	0.0754	0.0748
Trypanosoma brucei	protein kinase, putative	0.13	1	1
Schistosoma mansoni	sugar transporter	0.0016	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0584	0.443	0.4426
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0046	0.0246	0.024
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Entamoeba histolytica	protein kinase, putative	0.0046	0.0246	0.1906
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Toxoplasma gondii	lysine-tRNA ligase	0.0025	0.0078	0.0072
Brugia malayi	Sugar transporter family protein	0.0112	0.0754	0.0748
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0118	0.0803	0.0798
Mycobacterium ulcerans	carboxylesterase, LipT	0.0028	0.0099	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.13	1	1
Onchocerca volvulus		0.0256	0.1877	1
Echinococcus multilocularis	acetylcholinesterase	0.0164	0.1158	0.1153
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Brugia malayi	TAR-binding protein	0.0062	0.0363	0.0357
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Brugia malayi	Cation transporter family protein	0.0256	0.1877	0.1872
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0256	0.1877	0.1872
Giardia lamblia	Prolyl-tRNA synthetase	0.0034	0.0145	0.0139
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0047	0.0246	0.024
Loa Loa (eye worm)	sugar transporter	0.0112	0.0754	0.0748
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0256	0.1877	0.1872
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0112	0.0754	0.0748
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0028	0.0099	0.0093
Onchocerca volvulus		0.0028	0.0099	0.0497
Schistosoma mansoni	protein kinase	0.0046	0.0246	0.0246
Toxoplasma gondii	protein kinase, putative	0.0328	0.2437	0.2432
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0145	0.0139
Schistosoma mansoni	neurotransmitter gated ion channel	0.0118	0.0803	0.0803
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.13	1	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0256	0.1877	0.1877
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0078	0.0195
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0078	0.0195
Schistosoma mansoni	neurotransmitter gated ion channel	0.0138	0.0958	0.0958
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0256	0.1877	0.1872
Loa Loa (eye worm)	RNA binding protein	0.0062	0.0363	0.0357
Trypanosoma cruzi	hexose transporter	0.0035	0.0154	0.0148
Echinococcus multilocularis	mitogen activated protein kinase	0.13	1	1
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0112	0.0754	0.0748
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0154	0.0148
Echinococcus granulosus	neuroligin	0.0028	0.0099	0.0093
Mycobacterium tuberculosis	Probable dehydrogenase	0.0085	0.0547	0.8796
Schistosoma mansoni	lysyl-tRNA synthetase	0.0025	0.0078	0.0078
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0025	0.0078	0.0072
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0046	0.0246	0.024
Onchocerca volvulus		0.0256	0.1877	1
Echinococcus granulosus	glycine receptor subunit beta	0.0256	0.1877	0.1872
Brugia malayi	hypothetical protein	0.0028	0.0099	0.0093
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0256	0.1877	0.1872
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0256	0.1877	0.1872
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0047	0.0246	0.0654
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0047	0.0246	0.0654
Schistosoma mansoni	protein kinase	0.0046	0.0246	0.0246
Echinococcus granulosus	lysyl tRNA synthetase	0.0025	0.0078	0.0072
Leishmania major	glucose transporter, lmgt1	0.0035	0.0154	0.0148
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0256	0.1877	0.1872
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0028	0.0099	0.0093
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0154	0.0148
Echinococcus granulosus	c-Jun N-terminal kinases	0.0279	0.2058	0.2053
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0256	0.1877	0.1872
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0154	0.0148
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0118	0.0803	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0099	0.0093
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0803	0.0798
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0046	0.0246	0.024
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0047	0.0246	0.024
Onchocerca volvulus		0.0138	0.0958	0.5086
Echinococcus granulosus	para nitrobenzyl esterase	0.0028	0.0099	0.0093
Schistosoma mansoni	nAChR subunit	0.0256	0.1877	0.1877
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0118	0.0803	0.0798
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0047	0.0246	0.0654
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0118	0.0803	0.0798
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0016	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0958	0.0952
Loa Loa (eye worm)	cytochrome P450 family protein	0.0025	0.0082	0.0075
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0256	0.1877	0.1872
Loa Loa (eye worm)	hypothetical protein	0.0256	0.1877	0.1872
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0154	0.0148
Loa Loa (eye worm)	thioredoxin reductase	0.0037	0.0175	0.0168
Onchocerca volvulus		0.0256	0.1877	1
Echinococcus multilocularis	lysyl tRNA synthetase	0.0025	0.0078	0.0072
Schistosoma mansoni	glucose transport protein	0.0112	0.0754	0.0754
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0256	0.1877	0.1872
Echinococcus multilocularis	tar DNA binding protein	0.0062	0.0363	0.0357
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0256	0.1877	0.1877
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1158	0.1153
Onchocerca volvulus		0.0028	0.0099	0.0497

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.04	Inhibition of AChE (unknown origin) using acetylthiocholine chloride as substrate after 15 min by Ellman's method	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.

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External resources for this compound

ChEMBL: CHEMBL2234530

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1813580