TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 425.974 | Formula: C23H24ClN3OS
H donors: 1 H acceptors: 1 LogP: 5.61 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(cc1)C(=O)c1c(N)sc(c1CN1CCN(CC1)c1ccccc1)C
InChi: 1S/C23H24ClN3OS/c1-16-20(15-26-11-13-27(14-12-26)19-5-3-2-4-6-19)21(23(25)29-16)22(28)17-7-9-18(24)10-8-17/h2-10H,11-15,25H2,1H3
InChiKey: IUSKEAVVZQVOIW-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

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)	hypothetical protein	0.0019	0.0441	0.0434
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0009	0.0023	0.0085
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0441	0.0434
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Trypanosoma brucei	sterol 24-c-methyltransferase, putative	0.0194	0.7681	1
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0019	0.0441	0.0434
Schistosoma mansoni	neurotransmitter gated ion channel	0.001	0.0083	0.0407
Trypanosoma cruzi	sterol 24-c-methyltransferase, putative	0.0194	0.7681	0.5
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0009	0.0023	0.0085
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0019	0.0441	0.2321
Echinococcus multilocularis	serine threonine protein kinase	0.0048	0.1636	0.8707
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0441	0.0434
Onchocerca volvulus	Putative nachr subunit	0.0019	0.0441	0.0651
Onchocerca volvulus		0.001	0.0083	0.0094
Trypanosoma cruzi	sterol 24-c-methyltransferase, putative	0.0194	0.7681	0.5
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Brugia malayi	hypothetical protein	0.0009	0.0023	0.0016
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0009	0.0023	0.0016
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0441	0.2321
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0019	0.0441	0.0434
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.001	0.0083	0.0407
Loa Loa (eye worm)	GABA receptor subunit	0.001	0.0083	0.0076
Brugia malayi	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0441	0.2321
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Trypanosoma brucei	sterol 24-c-methyltransferase, putative	0.0194	0.7681	1
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0441	0.2321
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0009	0.0023	0.0016
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Onchocerca volvulus	Glucosylceramidase homolog	0.0164	0.6446	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.6811	0.6811
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0009	0.0023	0.0016
Echinococcus granulosus	nAChR subunit	0.001	0.0083	0.0407
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0441	0.2321
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0009	0.0023	0.0016
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0019	0.0441	0.2321
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0019	0.0441	0.0434
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0441	0.2321
Onchocerca volvulus		0.0019	0.0441	0.0651
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0441	0.0434
Brugia malayi	protein kinase C II.	0.0015	0.03	0.0292
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.001	0.0083	0.0076
Echinococcus granulosus	glycine receptor subunit beta	0.0019	0.0441	0.2321
Brugia malayi	Cation transporter family protein	0.0019	0.0441	0.0434
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0019	0.0441	0.0434
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Echinococcus granulosus	protein kinase c epsilon type	0.0015	0.03	0.1562
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Onchocerca volvulus		0.0019	0.0441	0.0651
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.001	0.0083	0.0407
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0019	0.0441	0.0434
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Brugia malayi	Cation transporter family protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	LGC-31 protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0249	1	1
Brugia malayi	hypothetical protein	0.0009	0.0023	0.0016
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0441	0.2321
Onchocerca volvulus		0.0019	0.0441	0.0651
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0019	0.0441	0.0434
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0009	0.0023	0.0016
Echinococcus granulosus	RNA directed DNA polymerase	0.0038	0.1243	0.6609
Brugia malayi	hypothetical protein	0.0009	0.0023	0.0016
Onchocerca volvulus		0.0019	0.0441	0.0651
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Onchocerca volvulus		0.0019	0.0441	0.0651
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0019	0.0441	0.0434
Trypanosoma brucei	sterol 24-c-methyltransferase, putative	0.0101	0.3846	0.5002
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Schistosoma mansoni	neurotransmitter gated ion channel	0.0009	0.0023	0.0085
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Schistosoma mansoni	atypical protein kinase C	0.0014	0.0249	0.1293
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.6811	0.6811
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0019	0.0441	0.2321
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Onchocerca volvulus		0.0019	0.0441	0.0651
Echinococcus granulosus	protein kinase c iota type	0.0014	0.0249	0.1293
Brugia malayi	Cation transporter family protein	0.0019	0.0441	0.0434
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0441	0.2321
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Echinococcus multilocularis	protein kinase c epsilon type	0.0015	0.03	0.1562
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0038	0.1243	0.6609
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0009	0.0023	0.0085
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0044	0.1485	0.1479
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0015	0.03	0.0292
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0053	0.1878	1
Loa Loa (eye worm)	hypothetical protein	0.0094	0.3572	0.3567
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0083	0.0076
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0019	0.0441	0.2321
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0009	0.0023	0.0085
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Trypanosoma brucei	Sterol methyltransferase, putative	0.0194	0.7681	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Entamoeba histolytica	hypothetical protein	0.001	0.0083	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0019	0.0441	0.2321
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0009	0.0023	0.0085
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0038	0.1243	0.1237
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0019	0.0441	0.0434
Echinococcus multilocularis	nAChR subunit	0.001	0.0083	0.0407
Schistosoma mansoni	serine/threonine protein kinase	0.0015	0.03	0.1562
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0019	0.0441	0.0434
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0019	0.0441	0.2321
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0019	0.0441	0.2321
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0441	0.2321
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0019	0.0441	0.2321
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0009	0.0023	0.0016
Schistosoma mansoni	nAChR subunit	0.0009	0.0023	0.0085
Brugia malayi	S-adenosyl-methionine cycloartenol-C24-methyltransferase	0.0094	0.3572	0.3567
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Schistosoma mansoni	acetylcholine receptor-related	0.0009	0.0023	0.0085
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.1878	1
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Loa Loa (eye worm)	ACC-1 protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Schistosoma mansoni	nAChR subunit	0.0009	0.0023	0.0085
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Leishmania major	sterol 24-c-methyltransferase, putative	0.0194	0.7681	0.5
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus multilocularis	RNA directed DNA polymerase	0.0038	0.1243	0.6609
Echinococcus granulosus	nAChR subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0019	0.0441	0.0434
Brugia malayi	excitatory GABA receptor EXP-1A	0.0019	0.0441	0.0434
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0009	0.0023	0.0016
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0019	0.0441	0.2321
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0019	0.0441	0.0434
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0019	0.0441	0.2321
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0009	0.0023	0.0085
Echinococcus granulosus	protein kinase C gamma type	0.0048	0.1636	0.8707
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Brugia malayi	hypothetical protein	0.0009	0.0023	0.0016
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.6446	0.6446
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Echinococcus granulosus	Protein kinase C brain isozyme	0.0053	0.1878	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0083	0.0076
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0019	0.0441	0.2321
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.001	0.0083	0.0076
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0009	0.0023	0.0016
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0083	0.0076
Trypanosoma cruzi	sterol 24-c-methyltransferase, putative	0.0194	0.7681	0.5
Onchocerca volvulus		0.001	0.0083	0.0094
Schistosoma mansoni	neurotransmitter gated ion channel	0.0009	0.0023	0.0085
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus multilocularis	nAChR subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0019	0.0441	0.0434
Loa Loa (eye worm)	acetylcholine receptor protein	0.0009	0.0023	0.0016
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Toxoplasma gondii	AGC kinase	0.0008	0.0007	0.5
Echinococcus multilocularis	protein kinase c iota type	0.0014	0.0249	0.1293
Trichomonas vaginalis	glucosylceramidase, putative	0.0249	1	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Leishmania major	sterol 24-c-methyltransferase, putative	0.0194	0.7681	0.5
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0019	0.0441	0.0434
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0019	0.0441	0.0434
Trichomonas vaginalis	AGC family protein kinase	0.0008	0.0007	0.0007
Echinococcus multilocularis	glycine receptor subunit beta	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.0039	0.1301	0.1294
Brugia malayi	Protein kinase c protein 2	0.0045	0.1543	0.1537
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0023	0.0016
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0019	0.0441	0.0434
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Schistosoma mansoni	nAChR subunit	0.0019	0.0441	0.2321
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0441	0.0434
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.1878	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	<= 12 %	Displacement of [3H]MRE-3008-F20 from human adenosine A3 receptor expressed in CHO cells at 10 uM after 120 mins by scintillation counting	ChEMBL.	22889387
Inhibition (binding)	<= 12 %	Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in CHO cells at 10 uM after 120 mins by scintillation counting	ChEMBL.	22889387
Inhibition (binding)	<= 12 %	Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells at 10 uM after 120 mins by scintillation counting	ChEMBL.	22889387
Inhibition (functional)	= 57 %	Allosteric enhancing activity at human adenosine A1 receptor expressed in CHO cells assessed as inhibition of forskolin-stimulated cAMP accumulation at 100 nM incubated for 10 mins prior to forskolin-stimulation measured after 5 mins by competition protein binding assay in presence of 2-chloro-N6-cyclopentyladenosine	ChEMBL.	22889387
Inhibition (functional)	= 59 %	Allosteric enhancing activity at human adenosine A1 receptor expressed in CHO cells assessed as inhibition of forskolin-stimulated cAMP accumulation at 10 uM incubated for 10 mins prior to forskolin-stimulation measured after 5 mins by competition protein binding assay	ChEMBL.	22889387

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: CHEMBL2172529

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1683023