TDR Targets

Basic information

Technical information

TDR Targets ID: 1488577
Name: 3,3-dimethyl-4-[2-[(4-oxo-6-propyl-1H-pyrimid in-2-yl)sulfanyl]acetyl]-1H-quinoxalin-2-one
MW: 386.468 | Formula: C19H22N4O3S
H donors: 2 H acceptors: 5 LogP: 2.87 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCCc1nc(SCC(=O)N2c3ccccc3NC(=O)C2(C)C)nc(c1)O
InChi: 1S/C19H22N4O3S/c1-4-7-12-10-15(24)22-18(20-12)27-11-16(25)23-14-9-6-5-8-13(14)21-17(26)19(23,2)3/h5-6,8-10H,4,7,11H2,1-3H3,(H,21,26)(H,20,22,24)
InChiKey: WOKXPAPZBYIVMF-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

3,3-dimethyl-4-[1-oxo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]-1H-quinoxalin-2-one
4-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one
3,3-dimethyl-4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]-1H-quinoxalin-2-one
T5521207
ZINC05642191

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	polymerase (DNA directed) iota	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.2068	0.2068
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0036	0.5902	0.5902
Loa Loa (eye worm)	ACC-1 protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0023	0.3134	0.3134
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0036	0.5902	0.5902
Giardia lamblia	DINP protein human, muc B family	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1579	0.2675
Onchocerca volvulus	Putative nachr subunit	0.0018	0.2068	0.3504
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0018	0.2068	0.2068
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.2068	0.2068
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.3134	0.5
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin B3, putative	0.0036	0.5902	1
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Entamoeba histolytica	cyclin family protein	0.0036	0.5902	0.7906
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclins, putative	0.0036	0.5902	1
Trypanosoma brucei	unspecified product	0.0016	0.1579	0.2675
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0023	0.3134	0.531
Toxoplasma gondii	hypothetical protein	0.0027	0.4025	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclins, putative	0.0036	0.5902	1
Plasmodium vivax	hypothetical protein, conserved	0.0009	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0023	0.3134	0.3134
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0018	0.2068	0.2068
Entamoeba histolytica	hypothetical protein	0.0043	0.7465	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.5902	1
Loa Loa (eye worm)	cyclin domain-containing protein	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.001	0.0248	0.0248
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Onchocerca volvulus		0.0018	0.2068	0.3504
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclins, putative	0.0036	0.5902	1
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Schistosoma mansoni	cyclins	0.0036	0.5902	0.5902
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.3134	0.531
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	1	1
Echinococcus granulosus	glycine receptor subunit beta	0.0018	0.2068	0.2068
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin B, putative	0.0036	0.5902	1
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.3134	0.3134
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Onchocerca volvulus		0.001	0.0248	0.0421
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Entamoeba histolytica	cyclin, putative	0.0036	0.5902	0.7906
Schistosoma mansoni	cyclin B	0.0036	0.5902	0.5902
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.001	0.0248	0.0248
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Trypanosoma cruzi	cyclin 6, putative	0.0036	0.5902	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.7465	0.7465
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Onchocerca volvulus		0.0036	0.5902	1
Loa Loa (eye worm)	LGC-31 protein	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin B, putative	0.0036	0.5902	1
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Entamoeba histolytica	hypothetical protein	0.0043	0.7465	1
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0018	0.2068	0.2068
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0018	0.2068	0.2068
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0023	0.3134	0.3134
Plasmodium vivax	cyclin homologue, putative	0.0009	0	0.5
Schistosoma mansoni	cyclin B3	0.0036	0.5902	0.5902
Schistosoma mansoni	DNA polymerase eta	0.0023	0.3134	0.3134
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0018	0.2068	0.2068
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0018	0.2068	0.2068
Entamoeba histolytica	cyclin, putative	0.0036	0.5902	0.7906
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0023	0.3134	0.5
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0018	0.2068	0.2068
Trypanosoma brucei	unspecified product	0.0016	0.1579	0.2675
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	1	1
Trichomonas vaginalis	cyclin B, putative	0.0036	0.5902	1
Echinococcus granulosus	cyclin B3 1	0.0036	0.5902	0.5902
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	1	1
Giardia lamblia	Cyclin A	0.0036	0.5902	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase IV, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	ACC-1 protein	0.0018	0.2068	0.2068
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0018	0.2068	0.2068
Brugia malayi	hypothetical protein	0.0043	0.7465	0.7465
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0018	0.2068	0.2068
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.7465	0.7465
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0018	0.2068	0.2068
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0023	0.3134	0.531
Brugia malayi	Cation transporter family protein	0.0018	0.2068	0.2068
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Echinococcus multilocularis	nAChR subunit	0.001	0.0248	0.0248
Trichomonas vaginalis	cyclins, putative	0.0036	0.5902	1
Plasmodium falciparum	cyclin	0.0036	0.5902	1
Onchocerca volvulus		0.0018	0.2068	0.3504
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.001	0.0248	0.0248
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Brugia malayi	Cation transporter family protein	0.0018	0.2068	0.2068
Echinococcus granulosus	cyclins	0.0036	0.5902	0.5902
Echinococcus granulosus	cyclins	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Onchocerca volvulus		0.0018	0.2068	0.3504
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin B, putative	0.0036	0.5902	1
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0023	0.3134	0.3134
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus multilocularis	dna polymerase eta	0.0023	0.3134	0.3134
Trichomonas vaginalis	cyclin D, putative	0.0036	0.5902	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0248	0.0248
Onchocerca volvulus		0.001	0.0248	0.0421
Echinococcus granulosus	cyclins	0.0036	0.5902	0.5902
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.001	0.0248	0.0248
Brugia malayi	ImpB/MucB/SamB family protein	0.0023	0.3134	0.3134
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	1	1
Echinococcus granulosus	nAChR subunit	0.0018	0.2068	0.2068
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Echinococcus granulosus	dna polymerase eta	0.0023	0.3134	0.3134
Plasmodium vivax	cyclin 4, putative	0.0009	0	0.5
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0018	0.2068	0.2068
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0023	0.3134	0.3134
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0018	0.2068	0.2068
Mycobacterium ulcerans	DNA polymerase IV	0.0023	0.3134	0.5
Echinococcus granulosus	cyclins	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin D, putative	0.0036	0.5902	1
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0018	0.2068	0.2068
Echinococcus granulosus	dna polymerase kappa	0.0023	0.3134	0.3134
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0018	0.2068	0.2068
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Leishmania major	DNA polymerase eta, putative	0.0023	0.3134	0.531
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0018	0.2068	0.2068
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.001	0.0248	0.0248
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1579	0.2675
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0036	0.5902	0.5902
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0023	0.3134	0.4198
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Trypanosoma brucei	mitotic cyclin 6	0.0036	0.5902	1
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0018	0.2068	0.2068
Leishmania major	cyclin	0.0036	0.5902	1
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0018	0.2068	0.2068
Echinococcus multilocularis	glycine receptor subunit beta	0.0018	0.2068	0.2068
Echinococcus granulosus	nAChR subunit	0.001	0.0248	0.0248
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Trypanosoma cruzi	DNA polymerase eta, putative	0.0023	0.3134	0.531
Onchocerca volvulus		0.0018	0.2068	0.3504
Brugia malayi	Cation transporter family protein	0.0018	0.2068	0.2068
Schistosoma mansoni	neurotransmitter gated ion channel	0.001	0.0248	0.0248
Echinococcus multilocularis	dna polymerase kappa	0.0023	0.3134	0.3134
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0023	0.3134	0.3134
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0018	0.2068	0.2068
Echinococcus granulosus	cyclins	0.0036	0.5902	0.5902
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.0036	0.5902	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Trichomonas vaginalis	DNA polymerase eta, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0036	0.5902	0.5902
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase kappa, putative	0.0016	0.1579	0.2675
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus granulosus	cyclin b3	0.0036	0.5902	0.5902
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	1	1
Trichomonas vaginalis	cyclin A, putative	0.0036	0.5902	1
Echinococcus granulosus	cyclin B	0.0036	0.5902	0.5902
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.7465	0.7465
Echinococcus multilocularis	nAChR subunit	0.0018	0.2068	0.2068
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0018	0.2068	0.2068
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclin B, putative	0.0036	0.5902	1
Echinococcus multilocularis	cyclin B	0.0036	0.5902	0.5902
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	1	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.2068	0.2068
Trypanosoma cruzi	cyclin, putative	0.0036	0.5902	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.2068	0.2068
Entamoeba histolytica	hypothetical protein	0.001	0.0248	0.0332
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase eta, putative	0.0023	0.3134	0.531
Giardia lamblia	Hypothetical protein	0.0036	0.5902	1
Entamoeba histolytica	hypothetical protein	0.0043	0.7465	1
Schistosoma mansoni	nAChR subunit	0.0018	0.2068	0.2068
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0018	0.2068	0.2068
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Trichomonas vaginalis	cyclins, putative	0.0036	0.5902	1
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.2068	0.2068
Echinococcus granulosus	glycine receptor subunit beta	0.0018	0.2068	0.2068
Entamoeba histolytica	cyclin family protein	0.0036	0.5902	0.7906
Giardia lamblia	G2/mitotic-specific cyclin B	0.0036	0.5902	1
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0018	0.2068	0.2068
Loa Loa (eye worm)	GABA receptor subunit	0.001	0.0248	0.0248
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	1	1
Trypanosoma cruzi	CYC2-like cyclin, putative	0.0036	0.5902	1
Plasmodium vivax	cyclin dependent kinase binding protein, putative	0.0009	0	0.5
Trypanosoma brucei	unspecified product	0.0023	0.3134	0.531
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0018	0.2068	0.2068
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Schistosoma mansoni	hypothetical protein	0.0043	0.7465	0.7465
Echinococcus multilocularis	cyclins	0.0036	0.5902	0.5902
Entamoeba histolytica	hypothetical protein	0.0043	0.7465	1
Leishmania major	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Loa Loa (eye worm)	hypothetical protein	0.0018	0.2068	0.2068
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Trypanosoma cruzi	cyclin, putative	0.0036	0.5902	1
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0018	0.2068	0.2068
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0018	0.2068	0.2068
Echinococcus multilocularis	cyclin b3	0.0036	0.5902	0.5902
Echinococcus multilocularis	glycine receptor subunit beta	0.0018	0.2068	0.2068
Echinococcus multilocularis	cyclin B3 1	0.0036	0.5902	0.5902
Loa Loa (eye worm)	hypothetical protein	0.001	0.0248	0.0248
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0036	0.5902	0.5902
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0018	0.2068	0.2068
Onchocerca volvulus		0.0018	0.2068	0.3504
Onchocerca volvulus		0.0018	0.2068	0.3504
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0018	0.2068	0.2068
Brugia malayi	excitatory GABA receptor EXP-1A	0.0018	0.2068	0.2068
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Trypanosoma brucei	DNA polymerase kappa, putative	0.0023	0.3134	0.531
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0023	0.3134	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	3.1623 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	3.5481 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	4.1095 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

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

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1699076

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1488577