TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 421.451 | Formula: C25H19N5O2
H donors: 1 H acceptors: 4 LogP: 4.4 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1)n1cc2c(n1)c(nc(n2)c1ccccc1)NC(=O)c1ccccc1
InChi: 1S/C25H19N5O2/c1-32-20-14-12-19(13-15-20)30-16-21-22(29-30)24(28-25(31)18-10-6-3-7-11-18)27-23(26-21)17-8-4-2-5-9-17/h2-16H,1H3,(H,26,27,28,31)
InChiKey: SLBHWADPYWJYRK-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
Trypanosoma brucei	protein kinase A regulatory subunit	0.0394	0.1054	1
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0197	0.0436	0.0395
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0591	0.1667	0.1784
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Leishmania major	cyclic nucleotide-binding protein-like protein	0.0394	0.1054	1
Echinococcus granulosus	potassium channel KvQLT family member kqt 1	0.0197	0.0436	0.0432
Schistosoma mansoni	camp-dependent protein kinase type I-beta regulatory subunit	0.0394	0.1054	0.1015
Echinococcus granulosus	patatin phospholipase domain containing protein	0.0394	0.1054	0.111
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Brugia malayi	olfactory channel protein osm-9	0.0197	0.0436	0.0432
Leishmania major	hypothetical protein, conserved	0.0197	0.0436	0.4139
Trichomonas vaginalis	adenylate cyclase type, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.279	0.853	1
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0591	0.1667	0.1784
Trichomonas vaginalis	adenylate cyclase type III, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	voltage gated potassium channel	0.0865	0.2523	0.2725
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	camp-dependent protein kinase type I-beta regulatory subunit	0.0394	0.1054	0.1015
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Brugia malayi	ion channel NompC	0.0197	0.0436	0.0432
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Schistosoma mansoni	serine/threonine protein kinase	0.0394	0.1054	0.1015
Leishmania major	regulatory subunit of protein kinase a-like protein	0.0394	0.1054	1
Echinococcus multilocularis	cGMP dependent protein kinase 1	0.0394	0.1054	0.111
Echinococcus granulosus	ryanodine receptor 44f	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0197	0.0436	0.0432
Loa Loa (eye worm)	voltage-gated potassium channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	sodium channel protein	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	voltage-gated potassium channel	0.0591	0.1667	0.1631
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0591	0.1667	0.1784
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Brugia malayi	Hypothetical UPF0028 protein ZK370.4 in chromosome III, putative	0.0394	0.1054	0.111
Loa Loa (eye worm)	ion channel NompC	0.0197	0.0436	0.0432
Echinococcus granulosus	Potassium voltage gated channel protein Shaw	0.0197	0.0436	0.0432
Brugia malayi	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	camp-dependent protein kinase type II regulatory subunit	0.0394	0.1054	0.1015
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Echinococcus multilocularis	potassium voltage gated channel subfamily A	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential gamma protein	0.0197	0.0436	0.0432
Mycobacterium tuberculosis	Probable conserved transmembrane transport protein	0.0394	0.1054	1
Trypanosoma cruzi	cyclic nucleotide-binding domain containing protein, putative	0.0394	0.1054	1
Trypanosoma brucei	cyclic nucleotide-binding domain containing protein, putative	0.0394	0.1054	1
Wolbachia endosymbiont of Brugia malayi	DNA gyrase subunit A	0.0243	0.058	1
Trypanosoma cruzi	cAMP binding protein, putative	0.0394	0.1054	1
Toxoplasma gondii	transporter, cation channel family protein	0.0197	0.0436	0.3888
Echinococcus granulosus	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Plasmodium vivax	DNA gyrase subunit B, putative	0.0128	0.0221	0.1757
Trypanosoma cruzi	inositol 1,4,5-trisphosphate receptor, putative	0.0197	0.0436	0.4139
Plasmodium falciparum	cGMP-dependent protein kinase	0.0394	0.1054	1
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0591	0.1667	0.1784
Toxoplasma gondii	DNA gyrase/topoisomerase IV, A subunit domain-containing protein	0.0243	0.058	0.5311
Echinococcus granulosus	voltage gated hydrogen channel 1	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	60S ribosomal protein L21	0.0471	0.1292	0.1255
Trichomonas vaginalis	adenylate cyclase type III, putative	0.0274	0.0679	0.0749
Treponema pallidum	DNA gyrase, subunit A (gyrA)	0.0243	0.058	0.4312
Echinococcus multilocularis	voltage gated hydrogen channel 1	0.0197	0.0436	0.0432
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0197	0.0436	0.0432
Echinococcus multilocularis	transfer RNA-Gly	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Toxoplasma gondii	hypothetical protein	0.0197	0.0436	0.3888
Mycobacterium tuberculosis	DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0243	0.058	0.4312
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.0197	0.0436	0.4139
Trypanosoma cruzi	cAMP response protein 1	0.0394	0.1054	1
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0274	0.0679	0.0749
Toxoplasma gondii	cAMP-dependent protein kinase regulatory subunit	0.0394	0.1054	1
Onchocerca volvulus		0.0394	0.1054	1
Brugia malayi	Ryanodine Receptor TM 4-6 family protein	0.0197	0.0436	0.0432
Schistosoma mansoni	calcium-activated potassium channel	0.0197	0.0436	0.0395
Trypanosoma brucei	Flagellar Member 6	0.0394	0.1054	1
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	sodium leak channel non selective protein	0.0197	0.0436	0.0432
Mycobacterium tuberculosis	Probable glutamine-transport ATP-binding protein ABC transporter GlnQ	0.0394	0.1054	1
Mycobacterium tuberculosis	Conserved protein	0.0394	0.1054	1
Toxoplasma gondii	transporter, cation channel family protein	0.0197	0.0436	0.3888
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.0197	0.0436	0.4139
Mycobacterium ulcerans	hypothetical protein	0.0394	0.1054	1
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit	0.0197	0.0436	0.0432
Schistosoma mansoni	inositol 145-trisphosphate receptor	0.0197	0.0436	0.0395
Echinococcus granulosus	voltage gated potassium channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Loa Loa (eye worm)	AGC/PKG protein kinase	0.0394	0.1054	0.111
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0591	0.1667	0.1784
Brugia malayi	N-terminal motif family protein	0.0394	0.1054	0.111
Echinococcus multilocularis	two pore calcium channel protein 2	0.0197	0.0436	0.0432
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0865	0.2523	0.2725
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0071	0.0043	0.0412
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0394	0.1054	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0394	0.1054	1
Echinococcus granulosus	shaker cognate	0.0197	0.0436	0.0432
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0591	0.1667	0.1631
Echinococcus multilocularis	voltage gated potassium channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium large conductance calcium activated	0.0197	0.0436	0.0432
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Echinococcus granulosus	short transient receptor potential channel 6	0.0197	0.0436	0.0432
Loa Loa (eye worm)	voltage-gated calcium channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0591	0.1667	0.1913
Schistosoma mansoni	voltage-dependent calcium channel	0.0197	0.0436	0.0395
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0197	0.0436	0.0432
Plasmodium falciparum	DNA gyrase subunit A	0.0243	0.058	0.5311
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Trichomonas vaginalis	guanylate cyclase beta 2 subunit, putative	0.0274	0.0679	0.0749
Loa Loa (eye worm)	ryanodine receptor	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Plasmodium vivax	DNA gyrase subunit A, putative	0.0243	0.058	0.5311
Echinococcus granulosus	voltage dependent calcium channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0197	0.0436	0.0432
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Leishmania major	hypothetical protein, conserved	0.0394	0.1054	1
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0394	0.1054	0.111
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Brugia malayi	cation channel family protein	0.0197	0.0436	0.0432
Mycobacterium tuberculosis	Probable transcriptional regulatory protein Cmr	0.0394	0.1054	1
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0591	0.1667	0.1784
Echinococcus granulosus	short transient receptor potential channel 6	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Echinococcus granulosus	hypothetical protein	0.0197	0.0436	0.0432
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0394	0.1054	1
Echinococcus multilocularis	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Schistosoma mansoni	transient receptor potential channel 4	0.0197	0.0436	0.0395
Schistosoma mansoni	two-pore calcium channel	0.0197	0.0436	0.0395
Echinococcus granulosus	potassium voltage gated channel subfamily C	0.0197	0.0436	0.0432
Trypanosoma brucei	STE group serine/threonine-protein kinase, putative	0.0274	0.0679	0.6445
Giardia lamblia	CAMP-dependent protein kinase regulatory chain	0.0394	0.1054	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.2987	0.9144	1
Trichomonas vaginalis	cAMP-dependent protein kinase type I-beta regulatory subunit, putative	0.0394	0.1054	0.1191
Trichomonas vaginalis	intestinal guanylate cyclase, putative	0.0274	0.0679	0.0749
Mycobacterium tuberculosis	Probable conserved transmembrane protein	0.0394	0.1054	1
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0197	0.0436	0.3888
Treponema pallidum	cyclic nucleotide binding protein	0.0394	0.1054	1
Treponema pallidum	catabolite gene activator (Crp)	0.0394	0.1054	1
Trichomonas vaginalis	adenylate cyclase type vIII, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	conserved hypothetical protein	0.0394	0.1054	0.1191
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Toxoplasma gondii	hypothetical protein	0.0197	0.0436	0.3888
Mycobacterium ulcerans	hypothetical protein	0.0394	0.1054	1
Leishmania major	hypothetical protein, unknown function	0.0394	0.1054	1
Echinococcus granulosus	voltage dependent calcium channel	0.0197	0.0436	0.0432
Leishmania major	protein kinase A regulatory subunit, putative	0.0394	0.1054	1
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0274	0.0679	0.0749
Mycobacterium ulcerans	hypothetical protein	0.0394	0.1054	1
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Trypanosoma cruzi	regulatory subunit of protein kinase a-like protein, putative	0.0394	0.1054	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0394	0.1054	0.1015
Echinococcus granulosus	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	sodium leak channel non selective protein	0.0197	0.0436	0.0432
Trypanosoma cruzi	Flagellar Member 6	0.0394	0.1054	1
Echinococcus granulosus	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0865	0.2523	0.2725
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0197	0.0436	0.4139
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Trypanosoma brucei	inositol 1,4,5-trisphosphate receptor	0.0197	0.0436	0.4139
Echinococcus multilocularis	shaker cognate	0.0197	0.0436	0.0432
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Trypanosoma brucei	DNA topoisomerase ii	0.0071	0.0043	0.0412
Brugia malayi	Cyclic-nucleotide gated cation channel, C. elegans tax-4 ortholog	0.0394	0.1054	0.111
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	cAMP dependent protein kinase type II regulatory	0.0394	0.1054	0.111
Brugia malayi	aryl hydrocarbon receptor nuclear translocator protein, putative	0.0274	0.0679	0.0699
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0394	0.1054	1
Echinococcus granulosus	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Echinococcus granulosus	two pore calcium channel protein 2	0.0197	0.0436	0.0432
Mycobacterium ulcerans	transcriptional regulatory protein	0.0394	0.1054	1
Plasmodium falciparum	cAMP-dependent protein kinase regulatory subunit	0.0394	0.1054	1
Mycobacterium ulcerans	DNA gyrase subunit A	0.0243	0.058	0.4312
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	sodium channel protein	0.0197	0.0436	0.0432
Loa Loa (eye worm)	calcium channel	0.0197	0.0436	0.0432
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0197	0.0436	0.0395
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus granulosus	voltage gated potassium channel	0.0865	0.2523	0.2725
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0394	0.1054	0.1015
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	ryanodine receptor related	0.0197	0.0436	0.0395
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	guanylate cyclase beta 1 subunit, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	hypothetical protein	0.0274	0.0679	0.0749
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0197	0.0436	0.3888
Brugia malayi	cAMP-dependent protein kinase regulatory chain, putative	0.0394	0.1054	0.111
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0197	0.0436	0.0395
Echinococcus granulosus	two pore calcium channel protein 1	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Chlamydia trachomatis	cAMP-dependent protein kinase regulatory subunit	0.0394	0.1054	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.2987	0.9144	1
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0394	0.1054	0.111
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Loa Loa (eye worm)	voltage-dependent calcium channel	0.0197	0.0436	0.0432
Leishmania major	hypothetical protein, conserved	0.0394	0.1054	1
Echinococcus granulosus	single minded 2	0.0274	0.0679	0.0699
Entamoeba histolytica	DNA topoisomerase II, putative	0.0071	0.0043	0.5
Brugia malayi	Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog	0.0197	0.0436	0.0432
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0591	0.1667	0.1784
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0591	0.1667	0.1631
Plasmodium vivax	CAMP-dependent protein kinase regulatory subunit, putative	0.0394	0.1054	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Schistosoma mansoni	serine/threonine protein kinase	0.0394	0.1054	0.1015
Schistosoma mansoni	transient receptor potential channel	0.0197	0.0436	0.0395
Echinococcus granulosus	cGMP dependent protein kinase	0.0394	0.1054	0.111
Schistosoma mansoni	camp-dependent rap1 guanine-nucleotide exchange factor	0.0394	0.1054	0.1015
Brugia malayi	Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit	0.0197	0.0436	0.0432
Trypanosoma brucei	cyclic nucleotide-binding domain containing protein, putative	0.0394	0.1054	1
Leishmania major	hypothetical protein, unknown function	0.0197	0.0436	0.4139
Toxoplasma gondii	protein kinase G AGC kinase family member PKG	0.0394	0.1054	1
Leishmania major	hypothetical protein, conserved	0.0394	0.1054	1
Echinococcus multilocularis	patatin phospholipase domain containing protein	0.0394	0.1054	0.111
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0591	0.1667	0.1784
Echinococcus multilocularis	calcium activated potassium channel	0.0197	0.0436	0.0432
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Mycobacterium ulcerans	hypothetical protein	0.0394	0.1054	1
Plasmodium vivax	rap guanine nucleotide exchange factor, putative	0.0394	0.1054	1
Trypanosoma cruzi	protein kinase A regulatory subunit	0.0394	0.1054	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Brugia malayi	Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog	0.0197	0.0436	0.0432
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0591	0.1667	0.1631
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Chlamydia trachomatis	DNA gyrase subunit A	0.0243	0.058	0.4312
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0591	0.1667	0.1784
Schistosoma mansoni	voltage-gated potassium channel	0.0865	0.2523	0.2491
Trichomonas vaginalis	adenylyl cyclase type V, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0394	0.1054	0.111
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Schistosoma mansoni	transient receptor potential channel	0.0197	0.0436	0.0395
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0197	0.0436	0.0432
Schistosoma mansoni	voltage-gated potassium channel	0.0865	0.2523	0.2491
Schistosoma mansoni	neuropathy target esterase/swiss cheese-related protein	0.0394	0.1054	0.1015
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Treponema pallidum	catabolite gene activator	0.0394	0.1054	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.279	0.853	1
Mycobacterium leprae	Possible transporter protein	0.0274	0.0679	0.5694
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0394	0.1054	0.1191
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Onchocerca volvulus		0.0197	0.0436	0.3888
Loa Loa (eye worm)	cAMP-dependent protein kinase regulatory subunit	0.0394	0.1054	0.111
Echinococcus multilocularis	transient receptor potential cation channel	0.0197	0.0436	0.0432
Echinococcus multilocularis	cAMP dependent protein kinase type I beta	0.0394	0.1054	0.111
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	ryanodine receptor 44f	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium voltage gated channel subfamily KQT	0.0197	0.0436	0.0432
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0394	0.1054	0.1191
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0197	0.0436	0.0395
Echinococcus granulosus	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Brugia malayi	Voltage-gated calcium channel, alpha subunit	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase type, putative	0.0274	0.0679	0.0749
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.2987	0.9144	1
Trypanosoma cruzi	cAMP response protein 1, putative	0.0394	0.1054	1
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	voltage dependent calcium channel	0.0197	0.0436	0.0432
Brugia malayi	voltage-dependent calcium channel	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0591	0.1667	0.1784
Loa Loa (eye worm)	hypothetical protein	0.0394	0.1054	0.111
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0591	0.1667	0.1631
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0394	0.1054	0.111
Echinococcus multilocularis	cAMP dependent protein kinase regulatory	0.0394	0.1054	0.111
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0591	0.1667	0.1784
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	voltage-gated cation channel	0.0197	0.0436	0.0395
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0197	0.0436	0.0395
Echinococcus multilocularis	voltage dependent calcium channel	0.0197	0.0436	0.0432
Brugia malayi	Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	short transient receptor potential channel 6	0.0197	0.0436	0.0432
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Trypanosoma cruzi	hypothetical protein, conserved	0.0394	0.1054	1
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	short transient receptor potential channel 6	0.0197	0.0436	0.0432
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0394	0.1054	1
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0394	0.1054	1
Echinococcus multilocularis	transient receptor potential gamma protein	0.0197	0.0436	0.0432
Trypanosoma brucei	cAMP response protein 1, putative	0.0394	0.1054	1
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0274	0.0679	0.0749
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0274	0.0679	0.0749
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0591	0.1667	0.1784
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	cGMP dependent protein kinase 1	0.0394	0.1054	0.111
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0591	0.1667	0.1913
Trichomonas vaginalis	adenylate cyclase type VI, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	voltage-gated potassium channel KCNQ	0.0197	0.0436	0.0395
Brugia malayi	Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog	0.0197	0.0436	0.0432
Schistosoma mansoni	serine/threonine protein kinase	0.0394	0.1054	0.1015
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0197	0.0436	0.0395
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0071	0.0043	0.0412
Echinococcus granulosus	cAMP dependent protein kinase type I beta	0.0394	0.1054	0.111
Loa Loa (eye worm)	voltage-gated potassium channel	0.0197	0.0436	0.0432
Onchocerca volvulus		0.0394	0.1054	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0865	0.2523	0.2725
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	TRP transient receptor potential channel	0.0197	0.0436	0.0432
Echinococcus granulosus	hyperpolarization activated cyclic	0.0591	0.1667	0.1784
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0197	0.0436	0.3888
Echinococcus granulosus	potassium voltage gated channel subfamily A	0.0197	0.0436	0.0432
Echinococcus granulosus	potassium large conductance calcium activated	0.0197	0.0436	0.0432
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Schistosoma mansoni	similar to Protein C20orf152 homolog	0.0394	0.1054	0.1015
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0197	0.0436	0.0432
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0197	0.0436	0.3888
Trichomonas vaginalis	cAMP-dependent protein kinase regulatory subunit, putative	0.0394	0.1054	0.1191
Trypanosoma cruzi	regulatory subunit of protein kinase a-like protein, putative	0.0394	0.1054	1
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Brugia malayi	Transient-receptor-potential like protein	0.0197	0.0436	0.0432
Schistosoma mansoni	hypothetical protein	0.0197	0.0436	0.0395
Trichomonas vaginalis	adenylate cyclase type, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	expressed conserved protein	0.0394	0.1054	0.111
Mycobacterium ulcerans	regulatory protein	0.0394	0.1054	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0865	0.2523	0.2725
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	transient receptor potential channel	0.0197	0.0436	0.0395
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Schistosoma mansoni	cyclic nucleotide-gated ion channel	0.0394	0.1054	0.1015
Echinococcus multilocularis	two pore calcium channel protein 1	0.0197	0.0436	0.0432
Echinococcus granulosus	cAMP dependent protein kinase regulatory	0.0394	0.1054	0.111
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0591	0.1667	0.1784
Loa Loa (eye worm)	hypothetical protein	0.2592	0.7913	0.8647
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	voltage-gated potassium channel	0.0197	0.0436	0.0395
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Echinococcus multilocularis	conserved hypothetical protein	0.0197	0.0436	0.0432
Mycobacterium leprae	Conserved hypothetical protein	0.0394	0.1054	1
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0197	0.0436	0.0395
Schistosoma mansoni	voltage-gated potassium channel	0.0471	0.1292	0.1255
Loa Loa (eye worm)	hypothetical protein	0.0394	0.1054	0.111
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog	0.0197	0.0436	0.0432
Echinococcus granulosus	hyperpolarization activated cyclic	0.0591	0.1667	0.1784
Schistosoma mansoni	hypothetical protein	0.0274	0.0679	0.0639
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0197	0.0436	0.0395
Brugia malayi	Egg laying defective protein 4	0.0394	0.1054	0.111
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0197	0.0436	0.0432
Echinococcus granulosus	calcium activated potassium channel	0.0197	0.0436	0.0432
Schistosoma mansoni	neuropathy target esterase/swiss cheese-related protein	0.0394	0.1054	0.1015
Mycobacterium ulcerans	transmembrane transport protein	0.0394	0.1054	1
Trichomonas vaginalis	adenylate cyclase, putative	0.0274	0.0679	0.0749
Leishmania major	mitochondrial DNA topoisomerase II	0.0071	0.0043	0.0412
Trichomonas vaginalis	conserved hypothetical protein	0.0274	0.0679	0.0749
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Schistosoma mansoni	camp-dependent protein kinase regulatory chain	0.0394	0.1054	0.1015
Toxoplasma gondii	transporter, cation channel family protein	0.0197	0.0436	0.3888
Leishmania major	protein kinase, putative	0.0394	0.1054	1
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Trichomonas vaginalis	guanylate cyclase, putative	0.0274	0.0679	0.0749
Echinococcus multilocularis	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0274	0.0679	0.0749
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Trypanosoma brucei	cAMP binding protein, putative	0.0394	0.1054	1
Leishmania major	protein kinase, putative	0.0394	0.1054	1
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0197	0.0436	0.0395
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0591	0.1667	0.1631
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0197	0.0436	0.0432
Echinococcus granulosus	transient receptor potential cation channel	0.0197	0.0436	0.0432
Treponema pallidum	cyclic nucleotide binding protein	0.0394	0.1054	1
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus multilocularis	potassium voltage gated channel protein	0.0197	0.0436	0.0432
Schistosoma mansoni	vesicular amine transporter	0.0197	0.0436	0.0395
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0197	0.0436	0.0432
Echinococcus granulosus	cGMP dependent protein kinase 1	0.0394	0.1054	0.111
Schistosoma mansoni	hypothetical protein	0.0394	0.1054	0.1015
Schistosoma mansoni	voltage-gated ion channel	0.0197	0.0436	0.0395
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0394	0.1054	1
Echinococcus multilocularis	cAMP dependent protein kinase type II regulatory	0.0394	0.1054	0.111
Brugia malayi	cation channel family protein	0.0197	0.0436	0.0432
Plasmodium falciparum	DNA gyrase subunit B	0.0128	0.0221	0.1757
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog	0.0197	0.0436	0.0432
Schistosoma mansoni	camp-dependent protein kinase type II-alpha regulatory subunit	0.0394	0.1054	0.1015
Schistosoma mansoni	calcium channel voltage-dependent p/q type alpha 1a-related	0.0197	0.0436	0.0395
Echinococcus multilocularis	potassium voltage gated channel subfamily C	0.0197	0.0436	0.0432
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0274	0.0679	0.0749
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.2987	0.9144	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 63 nM	Inhibition of human A3 adenosine receptor transfected in CHO cells assessed as inhibition of forskolin-induced cyclic AMP production after 10 mins by competitive protein binding assay in presence of CI-IB-MECA	ChEMBL.	23427825
Inhibition (binding)	= 1 %	Displacement of [3H]ZM241385 from human A2A adenosine receptor expressed in CHO cells at 1 uM after 60 mins by scintillation counting analysis	ChEMBL.	23427825
Inhibition (binding)	= 2 %	Inhibition of human A2B adenosine receptor transfected in CHO cells assessed as inhibition of NECA-induced cyclic AMP production at 1 uM after 10 mins by competitive protein binding assay	ChEMBL.	23427825
Inhibition (binding)	= 3 %	Displacement of [3H]DPCPX from human A1 adenosine receptor expressed in CHO cells at 1 uM after 120 mins by scintillation counting analysis	ChEMBL.	23427825
Inhibition (binding)	= 12 %	Displacement of [125I]AB-MECA from rat A3 adenosine receptor expressed in HEK293 cells at 1 uM after 60 mins by scintillation counting analysis	ChEMBL.	23427825
Ki (binding)	= 18 nM	Displacement of [125I]AB-MECA from human A3 adenosine receptor expressed in CHO cells after 60 mins by scintillation counting analysis	ChEMBL.	23427825

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: CHEMBL2322907

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1726024