TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 391.513 | Formula: C22H29N7
H donors: 3 H acceptors: 3 LogP: 5.01 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: C1CCC(CC1)Nc1nc(NN2CCC(CC2)c2ccccc2)nc2c1nc[nH]2
InChi: 1S/C22H29N7/c1-3-7-16(8-4-1)17-11-13-29(14-12-17)28-22-26-20-19(23-15-24-20)21(27-22)25-18-9-5-2-6-10-18/h1,3-4,7-8,15,17-18H,2,5-6,9-14H2,(H3,23,24,25,26,27,28)
InChiKey: OMGRYJUMIOVZQQ-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	adenosine A3 receptor	Starlite/ChEMBL	References

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
Schistosoma mansoni	cyclin k	0.0012	0.0056	0.0056
Echinococcus granulosus	cyclins	0.0052	0.0867	0.0867
Schistosoma mansoni	hypothetical protein	0.0012	0.0056	0.0056
Echinococcus granulosus	cyclins	0.0052	0.0867	0.0867
Echinococcus granulosus	cyclin t1	0.0012	0.0056	0.0056
Schistosoma mansoni	serine/threonine protein kinase	0.0492	1	1
Echinococcus granulosus	cyclin B3 1	0.0052	0.0867	0.0867
Entamoeba histolytica	cyclin, domain containing protein	0.0012	0.0056	0.0056
Echinococcus multilocularis	cyclin B	0.01	0.1865	0.1865
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin dependent kinase 1	0.0492	1	1
Echinococcus multilocularis	cyclin B3 1	0.0052	0.0867	0.0867
Echinococcus granulosus	cyclins	0.0052	0.0867	0.0867
Onchocerca volvulus		0.0018	0.0173	0.0929
Trypanosoma cruzi	cyclin, putative	0.01	0.1865	0.1819
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0018	0.0173	0.0173
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0018	0.0173	0.0173
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Entamoeba histolytica	cyclin C, putative	0.0012	0.0056	0.0056
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Echinococcus granulosus	cyclin dependent kinase	0.0492	1	1
Trichomonas vaginalis	cyclin B, putative	0.01	0.1865	0.1819
Entamoeba histolytica	cyclin family protein	0.0052	0.0867	0.0867
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.01	0.1865	0.1819
Echinococcus granulosus	cyclins	0.0052	0.0867	0.0867
Brugia malayi	Cation transporter family protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0492	1	1
Echinococcus granulosus	G1:S specific cyclin D1	0.0012	0.0056	0.0056
Brugia malayi	excitatory GABA receptor EXP-1A	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Onchocerca volvulus		0.0018	0.0173	0.0929
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Brugia malayi	hypothetical protein	0.0012	0.0056	0.0056
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Trypanosoma cruzi	cyclin 6, putative	0.01	0.1865	0.1819
Echinococcus multilocularis	cyclin dependent kinase 5	0.0492	1	1
Trichomonas vaginalis	CMGC family protein kinase	0.0492	1	1
Onchocerca volvulus	Cyclin L homolog	0.0012	0.0056	0.0299
Schistosoma mansoni	g1/s-specific cyclin C	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Trichomonas vaginalis	conserved hypothetical protein	0.0052	0.0867	0.0816
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0018	0.0173	0.0173
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin t1	0.0012	0.0056	0.0056
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.0159	0.3102	0.3102
Trypanosoma cruzi	cyclin, putative	0.01	0.1865	0.1819
Echinococcus granulosus	cyclin G2	0.0012	0.0056	0.0056
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin dependent kinase	0.0492	1	1
Echinococcus multilocularis	cyclin b3	0.0052	0.0867	0.0867
Echinococcus granulosus	cyclin k	0.0012	0.0056	0.0056
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.0173	0.0173
Brugia malayi	Cyclin C	0.0012	0.0056	0.0056
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0492	1	1
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Echinococcus granulosus	cyclin G2	0.0012	0.0056	0.0056
Onchocerca volvulus		0.0018	0.0173	0.0929
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0018	0.0173	0.0173
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0018	0.0173	0.0173
Brugia malayi	Protein kinase domain containing protein	0.0492	1	1
Plasmodium falciparum	cyclin	0.0052	0.0867	0.0816
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclins, putative	0.0052	0.0867	0.0816
Schistosoma mansoni	cyclin B	0.01	0.1865	0.1865
Loa Loa (eye worm)	LGC-31 protein	0.0018	0.0173	0.0173
Echinococcus granulosus	cyclin	0.0012	0.0056	0.0056
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclin D, putative	0.0052	0.0867	0.0816
Onchocerca volvulus		0.0012	0.0056	0.0299
Trypanosoma cruzi	cdc2-related kinase 1	0.0492	1	1
Echinococcus granulosus	cyclin A3 4	0.0012	0.0056	0.0056
Entamoeba histolytica	cell division protein kinase 2, putative	0.0492	1	1
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Giardia lamblia	Hypothetical protein	0.0052	0.0867	0.0816
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Entamoeba histolytica	cyclin, domain containing protein	0.0012	0.0056	0.0056
Schistosoma mansoni	Cyclin fold protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Echinococcus granulosus	cyclin dependent kinase 1	0.0492	1	1
Echinococcus multilocularis	cdk5 and abl1 enzyme substrate 1	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Trichomonas vaginalis	cyclins, putative	0.01	0.1865	0.1819
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0492	1	1
Echinococcus multilocularis	cyclin A3 4	0.0012	0.0056	0.0056
Echinococcus multilocularis	G1:S specific cyclin D1	0.0012	0.0056	0.0056
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin k	0.0012	0.0056	0.0056
Trichomonas vaginalis	cyclin D, putative	0.0052	0.0867	0.0816
Echinococcus multilocularis	glycine receptor subunit beta	0.0018	0.0173	0.0173
Onchocerca volvulus		0.01	0.1865	1
Echinococcus granulosus	cyclin B	0.01	0.1865	0.1865
Onchocerca volvulus	Protein CNPPD1 homolog	0.0012	0.0056	0.0299
Schistosoma mansoni	cyclin d	0.0012	0.0056	0.0056
Echinococcus granulosus	oligomeric golgi complex subunit 3	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Leishmania major	cyclin	0.01	0.1865	0.1819
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0486	0.9891	0.9891
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0018	0.0173	0.0173
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0018	0.0173	0.0173
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Schistosoma mansoni	cyclin B3	0.0159	0.3102	0.3102
Echinococcus multilocularis	cyclin	0.0012	0.0056	0.0056
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0795	0.0795
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Trichomonas vaginalis	cyclin B, putative	0.01	0.1865	0.1819
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Trypanosoma brucei	cdc2-related kinase 1	0.0492	1	1
Giardia lamblia	Cyclin A	0.0052	0.0867	0.0816
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Echinococcus multilocularis	Cyclin L1	0.0012	0.0056	0.0056
Onchocerca volvulus	Cyclin L homolog	0.0012	0.0056	0.0299
Echinococcus multilocularis	glycine receptor subunit beta	0.0018	0.0173	0.0173
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Echinococcus granulosus	glycine receptor subunit beta	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclins, putative	0.01	0.1865	0.1819
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	cyclin fold protein 1 variant b	0.0012	0.0056	0.0056
Entamoeba histolytica	cyclin family protein	0.0052	0.0867	0.0867
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclins, putative	0.0061	0.1053	0.1003
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0492	1	1
Echinococcus multilocularis	cyclin y	0.0012	0.0056	0.0056
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0018	0.0173	0.0173
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0159	0.3102	0.3102
Schistosoma mansoni	proteasome subunit alpha 1 (T01 family)	0.0012	0.0056	0.0056
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0018	0.0173	0.0173
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.0173	0.0173
Plasmodium vivax	protein kinase Crk2	0.0492	1	1
Brugia malayi	Cation transporter family protein	0.0018	0.0173	0.0173
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Giardia lamblia	Kinase, CMGC CDK	0.0492	1	1
Loa Loa (eye worm)	hypothetical protein	0.01	0.1865	0.1865
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0018	0.0173	0.0173
Schistosoma mansoni	serine/threonine protein kinase	0.0492	1	1
Entamoeba histolytica	cyclin, putative	0.01	0.1865	0.1865
Echinococcus multilocularis	nAChR subunit	0.0018	0.0173	0.0173
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0018	0.0173	0.0173
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0018	0.0173	0.0173
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Onchocerca volvulus		0.0018	0.0173	0.0929
Trichomonas vaginalis	cyclins, putative	0.01	0.1865	0.1819
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclin B, putative	0.01	0.1865	0.1819
Brugia malayi	hypothetical protein	0.0012	0.0056	0.0056
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Brugia malayi	MH2 domain containing protein	0.0124	0.2376	0.2376
Echinococcus granulosus	cdk5 and abl1 enzyme substrate 1	0.0012	0.0056	0.0056
Schistosoma mansoni	hypothetical protein	0.0012	0.0056	0.0056
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0492	1	1
Trypanosoma cruzi	cdc2-related kinase 3	0.0492	1	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0492	1	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Giardia lamblia	Kinase, CMGC CDK	0.0492	1	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0018	0.0173	0.0173
Echinococcus granulosus	cyclin y	0.0012	0.0056	0.0056
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0018	0.0173	0.0173
Brugia malayi	Cyclin, N-terminal domain containing protein	0.01	0.1865	0.1865
Trichomonas vaginalis	CMGC family protein kinase	0.0492	1	1
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0056	0.0056
Onchocerca volvulus		0.0018	0.0173	0.0929
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Entamoeba histolytica	hypothetical protein	0.0012	0.0056	0.0056
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.0159	0.3102	0.3102
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclins, putative	0.01	0.1865	0.1819
Brugia malayi	Cation transporter family protein	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclin A, putative	0.01	0.1865	0.1819
Echinococcus granulosus	Cyclin L1	0.0012	0.0056	0.0056
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0018	0.0173	0.0173
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin G2	0.0012	0.0056	0.0056
Echinococcus multilocularis	oligomeric golgi complex subunit 3	0.0012	0.0056	0.0056
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Schistosoma mansoni	cyclin G	0.0012	0.0056	0.0056
Trypanosoma brucei	cdc2-related kinase 3	0.0492	1	1
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0018	0.0173	0.0173
Echinococcus granulosus	cyclin dependent kinase 5	0.0492	1	1
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0018	0.0173	0.0173
Echinococcus granulosus	nAChR subunit	0.0018	0.0173	0.0173
Trypanosoma cruzi	cdc2-related kinase 3	0.0492	1	1
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Plasmodium falciparum	protein kinase 5	0.0492	1	1
Brugia malayi	Cyclin, N-terminal domain containing protein	0.01	0.1865	0.1865
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclin B, putative	0.0052	0.0867	0.0816
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	ACC-1 protein	0.0018	0.0173	0.0173
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0492	1	1
Echinococcus granulosus	cyclins	0.0012	0.0056	0.0056
Schistosoma mansoni	cyclins	0.0052	0.0867	0.0867
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Echinococcus granulosus	glycine receptor subunit beta	0.0018	0.0173	0.0173
Onchocerca volvulus	Putative nachr subunit	0.0018	0.0173	0.0929
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0018	0.0173	0.0173
Schistosoma mansoni	cyclin G2	0.0012	0.0056	0.0056
Trypanosoma brucei	mitotic cyclin 6	0.01	0.1865	0.1819
Loa Loa (eye worm)	transcription factor SMAD2	0.0124	0.2376	0.2376
Onchocerca volvulus		0.0018	0.0173	0.0929
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0018	0.0173	0.0173
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0018	0.0173	0.0173
Echinococcus multilocularis	cyclin G2	0.0012	0.0056	0.0056
Echinococcus multilocularis	cyclin y	0.0012	0.0056	0.0056
Echinococcus granulosus	cyclin b3	0.0052	0.0867	0.0867
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0012	0.0056	0.0056
Trypanosoma cruzi	cdc2-related kinase 1	0.0492	1	1
Entamoeba histolytica	cell division protein kinase 2, putative	0.0492	1	1
Toxoplasma gondii	hypothetical protein	0.0039	0.0609	0.0556
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Loa Loa (eye worm)	ACC-1 protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	CYL-1 protein	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0018	0.0173	0.0173
Giardia lamblia	G2/mitotic-specific cyclin B	0.01	0.1865	0.1819
Echinococcus granulosus	cyclin y	0.0012	0.0056	0.0056
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0018	0.0173	0.0173
Loa Loa (eye worm)	cyclin domain-containing protein	0.0159	0.3102	0.3102
Schistosoma mansoni	nAChR subunit	0.0018	0.0173	0.0173
Trypanosoma cruzi	CYC2-like cyclin, putative	0.01	0.1865	0.1819
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0018	0.0173	0.0173
Entamoeba histolytica	cyclin, putative	0.0052	0.0867	0.0867
Echinococcus multilocularis	cyclins	0.0052	0.0867	0.0867
Echinococcus multilocularis	cyclin dependent kinase 1	0.0492	1	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0173	0.0173
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0018	0.0173	0.0173
Trichomonas vaginalis	cyclin B3, putative	0.0052	0.0867	0.0816
Echinococcus granulosus	cyclins	0.0052	0.0867	0.0867
Loa Loa (eye worm)	cyclin C	0.0012	0.0056	0.0056
Loa Loa (eye worm)	hypothetical protein	0.01	0.1865	0.1865
Schistosoma mansoni	cyclin l	0.0012	0.0056	0.0056
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0018	0.0173	0.0173
Loa Loa (eye worm)	cyclin domain-containing protein	0.0012	0.0056	0.0056
Brugia malayi	cyclin fold protein 1 variant b	0.0012	0.0056	0.0056
Trichomonas vaginalis	cyclin B, putative	0.01	0.1865	0.1819
Loa Loa (eye worm)	MH2 domain-containing protein	0.0124	0.2376	0.2376
Trichomonas vaginalis	CMGC family protein kinase	0.0492	1	1
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0018	0.0173	0.0173

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	= 16 %	Percent inhibition of [3H]-DPCPX binding to human adenosine A1 receptor expressed in CHO cells at 10 uM	ChEMBL.	16033270
Inhibition (binding)	= 16 %	Percent inhibition of [3H]-DPCPX binding to human adenosine A1 receptor expressed in CHO cells at 10 uM	ChEMBL.	16033270
Inhibition (binding)	= 50 %	Percent inhibition of [3H]-DPCPX binding to human adenosine A2A receptor expressed in CHO cells at 10 uM	ChEMBL.	16033270
Inhibition (binding)	= 50 %	Percent inhibition of [3H]-DPCPX binding to human adenosine A2A receptor expressed in CHO cells at 10 uM	ChEMBL.	16033270
Ki (binding)	= 1.57 uM	Inhibition of [125I]- AB-MECA binding to human adenosine A3 receptor expressed in CHO cells	ChEMBL.	16033270
Ki (binding)	= 1.57 uM	Inhibition of [125I]- AB-MECA binding to human adenosine A3 receptor expressed in CHO cells	ChEMBL.	16033270

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: CHEMBL362740

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 329067