TDR Targets

Basic information

Technical information

TDR Targets ID: 111212
Name: 1-[(3,5-dimethylphenyl)methoxy]-3-(1H-indol-3 -yl)propan-2-amine
MW: 308.417 | Formula: C20H24N2O
H donors: 2 H acceptors: 0 LogP: 3.51 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: NC(Cc1c[nH]c2c1cccc2)COCc1cc(C)cc(c1)C
InChi: 1S/C20H24N2O/c1-14-7-15(2)9-16(8-14)12-23-13-18(21)10-17-11-22-20-6-4-3-5-19(17)20/h3-9,11,18,22H,10,12-13,21H2,1-2H3
InChiKey: LSAWEFOQDMPCLG-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

1-[(3,5-dimethylphenyl)methoxy]-3-(1H-indol-3-yl)-2-propanamine
[1-[(3,5-dimethylbenzyl)oxymethyl]-2-(1H-indol-3-yl)ethyl]amine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	tachykinin receptor 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04224 tachykinin receptor 3, putative	Get druggable targets OG5_137770	All targets in OG5_137770

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0415	0.1727	0.1727
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Brugia malayi	Cation transporter family protein	0.0415	0.1727	0.1727
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1331	1	1
Echinococcus granulosus	cathepsin b	0.1331	1	1
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Schistosoma mansoni	cathepsin F (C01 family)	0.0632	0.369	0.369
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0415	0.1727	0.1727
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Entamoeba histolytica	cysteine protease, putative	0.0632	0.369	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Loa Loa (eye worm)	ctsf protein	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.0435	0.1913	0.1913
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Onchocerca volvulus		0.0632	0.369	1
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0415	0.1727	0.1727
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0415	0.1727	0.1727
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Entamoeba histolytica	cysteine proteinase, putative	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0343	0.1083	0.1083
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Onchocerca volvulus		0.0415	0.1727	0.4681
Loa Loa (eye worm)	hypothetical protein	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0632	0.369	0.369
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin b	0.1331	1	1
Loa Loa (eye worm)	cathepsin B	0.0513	0.2613	0.2613
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Onchocerca volvulus		0.0632	0.369	1
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0415	0.1727	0.1727
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Onchocerca volvulus		0.0415	0.1727	0.4681
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Brugia malayi	Papain family cysteine protease containing protein	0.0343	0.1083	0.1083
Plasmodium vivax	vivapain-2	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0632	0.369	1
Onchocerca volvulus		0.0415	0.1727	0.4681
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine proteinase, putative	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Echinococcus multilocularis	glycine receptor subunit beta	0.0415	0.1727	0.1727
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0415	0.1727	0.1727
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0415	0.1727	0.1727
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0415	0.1727	0.1727
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Loa Loa (eye worm)	LGC-31 protein	0.0415	0.1727	0.1727
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Brugia malayi	excitatory GABA receptor EXP-1A	0.0415	0.1727	0.1727
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0632	0.369	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0415	0.1727	0.1727
Brugia malayi	cathepsin L-like precursor	0.0435	0.1913	0.1913
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0415	0.1727	0.1727
Brugia malayi	Papain family cysteine protease containing protein	0.0632	0.369	0.369
Onchocerca volvulus		0.0415	0.1727	0.4681
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Echinococcus multilocularis	nAChR subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0632	0.369	0.369
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0632	0.369	0.369
Echinococcus multilocularis	cysteine protease	0.0632	0.369	0.369
Onchocerca volvulus		0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine proteinase, putative	0.0343	0.1083	0.2935
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Echinococcus multilocularis	cysteine protease	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.1331	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1331	1	1
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0415	0.1727	0.1727
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0415	0.1727	0.1727
Schistosoma mansoni	cathepsin F (C01 family)	0.0435	0.1913	0.1913
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Onchocerca volvulus	Cathepsin L homolog	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Loa Loa (eye worm)	cysteine protease	0.0632	0.369	0.369
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Entamoeba histolytica	cysteine proteinase, putative	0.0435	0.1913	0.5183
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1331	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0632	0.369	0.2924
Plasmodium vivax	vivapain-2	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Brugia malayi	Cation transporter family protein	0.0415	0.1727	0.1727
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Onchocerca volvulus		0.0435	0.1913	0.5183
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0632	0.369	0.369
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0415	0.1727	0.1727
Toxoplasma gondii	cathepsin CPL	0.0632	0.369	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0513	0.2613	0.2613
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin L cysteine protease	0.0632	0.369	0.369
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0513	0.2613	0.5868
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0415	0.1727	0.1727
Onchocerca volvulus	Cathepsin L homolog	0.0632	0.369	1
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Onchocerca volvulus		0.0632	0.369	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0435	0.1913	0.3182
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0435	0.1913	0.1913
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0415	0.1727	0.1727
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0435	0.1913	0.3182
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0632	0.369	1
Echinococcus multilocularis	glycine receptor subunit beta	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Giardia lamblia	Cathepsin B precursor	0.0513	0.2613	0.5
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Onchocerca volvulus		0.0415	0.1727	0.4681
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Echinococcus granulosus	cathepsin L cysteine protease	0.0343	0.1083	0.1083
Brugia malayi	Cathepsin L-like precursor	0.0435	0.1913	0.1913
Loa Loa (eye worm)	hypothetical protein	0.0435	0.1913	0.1913
Echinococcus granulosus	cathepsin L	0.0343	0.1083	0.1083
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Onchocerca volvulus	Putative nachr subunit	0.0415	0.1727	0.4681
Echinococcus granulosus	nAChR subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0632	0.369	0.369
Onchocerca volvulus		0.0632	0.369	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine proteinase, putative	0.0343	0.1083	0.2935
Brugia malayi	Cathepsin L-like precursor	0.0435	0.1913	0.1913
Giardia lamblia	Cathepsin B precursor	0.0513	0.2613	0.5
Echinococcus granulosus	glycine receptor subunit beta	0.0415	0.1727	0.1727
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0435	0.1913	0.093
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Echinococcus granulosus	cathepsin l1	0.0632	0.369	0.369
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0513	0.2613	0.5868
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0415	0.1727	0.1727
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0415	0.1727	0.1727
Echinococcus granulosus	cathepsin b	0.1331	1	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1331	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0632	0.369	0.2924
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0415	0.1727	0.1727
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0415	0.1727	0.1727
Brugia malayi	Cation transporter family protein	0.0415	0.1727	0.1727
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0415	0.1727	0.1727
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin L cysteine protease	0.0632	0.369	0.369
Giardia lamblia	Cathepsin B precursor	0.0513	0.2613	0.5
Leishmania major	cathepsin L-like protease	0.0632	0.369	1
Onchocerca volvulus		0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0632	0.369	1
Loa Loa (eye worm)	fibroinase	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Trypanosoma cruzi	cruzipain precursor, putative	0.0632	0.369	0.2924
Loa Loa (eye worm)	ACC-1 protein	0.0415	0.1727	0.1727
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Schistosoma mansoni	cathepsin F (C01 family)	0.0632	0.369	0.369
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0415	0.1727	0.1727
Trypanosoma cruzi	cysteine peptidase, putative	0.0632	0.369	0.2924
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Onchocerca volvulus	Cathepsin F homolog	0.0632	0.369	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0632	0.369	0.2924
Onchocerca volvulus		0.0632	0.369	1
Entamoeba histolytica	cysteine proteinase, putative	0.0343	0.1083	0.2935
Entamoeba histolytica	cysteine proteinase 1, putative	0.0343	0.1083	0.2935
Entamoeba histolytica	cysteine proteinase, putative	0.0343	0.1083	0.2935
Echinococcus granulosus	cathepsin l1	0.0435	0.1913	0.1913
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0343	0.1083	0.1083
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0632	0.369	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0513	0.2613	0.1716
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0415	0.1727	0.1727
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0435	0.1913	0.1913
Brugia malayi	Papain family cysteine protease containing protein	0.0343	0.1083	0.1083
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Brugia malayi	Cathepsin L-like precursor	0.0632	0.369	0.369
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1331	1	1
Entamoeba histolytica	cysteine protease, putative	0.0343	0.1083	0.2935
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0415	0.1727	0.1727
Onchocerca volvulus		0.0415	0.1727	0.4681
Loa Loa (eye worm)	ACC-1 protein	0.0415	0.1727	0.1727
Echinococcus multilocularis	cathepsin L	0.0343	0.1083	0.1083
Entamoeba histolytica	cysteine proteinase 2	0.0343	0.1083	0.2935
Echinococcus granulosus	cysteine protease	0.0343	0.1083	0.1083
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0632	0.369	1
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0415	0.1727	0.1727
Echinococcus granulosus	glycine receptor subunit beta	0.0415	0.1727	0.1727
Schistosoma mansoni	nAChR subunit	0.0415	0.1727	0.1727
Loa Loa (eye worm)	hypothetical protein	0.0415	0.1727	0.1727
Leishmania major	cysteine peptidase A (CPA)	0.0632	0.369	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0632	0.369	1
Echinococcus multilocularis	cathepsin b	0.1331	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0343	0.1083	0.1083

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2333 nM	Binding affinity of compound was determined from inhibition of [125I]- substance P binding to the hNK1 receptor in CHO cells	ChEMBL.	No reference
IC50 (binding)	= 2333 nM	Binding affinity of compound was determined from inhibition of [125I]- substance P binding to the hNK1 receptor in CHO cells	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

PubChem: 10448006

Bibliographic References

No literature references available for this target.

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Detailed information for compound 111212