TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 440.555 | Formula: C24H28N2O4S
H donors: 2 H acceptors: 4 LogP: 3.9 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: OCC(COc1c(C)cc(cc1C)c1nnc(o1)c1sc(c2c1C[C@@H]1[C@H]2C1(C)C)C)O
InChi: 1S/C24H28N2O4S/c1-11-6-14(7-12(2)20(11)29-10-15(28)9-27)22-25-26-23(30-22)21-16-8-17-19(24(17,4)5)18(16)13(3)31-21/h6-7,15,17,19,27-28H,8-10H2,1-5H3/t15?,17-,19-/m1/s1
InChiKey: KIBFXAUDRMTBKU-GERZZCHPSA-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	sphingosine-1-phosphate receptor 1	Starlite/ChEMBL	References
Homo sapiens	sphingosine-1-phosphate receptor 3	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
Echinococcus granulosus	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium large conductance calcium activated	0.0052	0.0181	0.0181
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.1672	1	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated cation channel	0.0052	0.0181	0.0181
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.1672	1	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0052	0.0181	0.0181
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0022	0	0.5
Schistosoma mansoni	calcium channel voltage-dependent p/q type alpha 1a-related	0.0052	0.0181	0.0181
Echinococcus multilocularis	transfer RNA-Gly	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential gamma protein	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated calcium channel, alpha subunit	0.0052	0.0181	0.0181
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	calcium activated potassium channel	0.0067	0.0273	0.0273
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0052	0.0181	0.0181
Loa Loa (eye worm)	ion channel NompC	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0052	0.0181	0.0181
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0052	0.0181	0.5
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	voltage-gated calcium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	mitogen activated protein kinase	0.1672	1	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	ryanodine receptor 44f	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0022	0	0.5
Brugia malayi	ion channel NompC	0.0052	0.0181	0.0181
Onchocerca volvulus		0.0052	0.0181	0.5
Schistosoma mansoni	60S ribosomal protein L21	0.0052	0.0181	0.0181
Trichomonas vaginalis	CMGC family protein kinase	0.1672	1	1
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0052	0.0181	0.0181
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	short transient receptor potential channel 6	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0052	0.0181	0.0181
Echinococcus multilocularis	conserved hypothetical protein	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	calcium-activated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0052	0.0181	0.0181
Echinococcus multilocularis	sodium channel protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0052	0.0181	0.0181
Schistosoma mansoni	hypothetical protein	0.0194	0.1041	0.1041
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Brugia malayi	Ryanodine Receptor TM 4-6 family protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage gated hydrogen channel 1	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus granulosus	hypothetical protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0052	0.0181	0.0181
Echinococcus multilocularis	transient receptor potential gamma protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily A	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage dependent calcium channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0052	0.0181	0.0181
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0052	0.0181	0.0181
Schistosoma mansoni	serine/threonine protein kinase	0.1672	1	1
Echinococcus multilocularis	voltage gated potassium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage gated hydrogen channel 1	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0052	0.0181	0.0181
Echinococcus granulosus	two pore calcium channel protein 2	0.0052	0.0181	0.0181
Schistosoma mansoni	ryanodine receptor related	0.0052	0.0181	0.0181
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Echinococcus granulosus	hyperpolarization activated cyclic	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit	0.0052	0.0181	0.0181
Echinococcus multilocularis	geminin	0.0194	0.1041	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.1672	1	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	short transient receptor potential channel 6	0.0052	0.0181	0.0181
Trypanosoma cruzi	inositol 1,4,5-trisphosphate receptor, putative	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	two pore calcium channel protein 1	0.0052	0.0181	0.0181
Echinococcus multilocularis	mitogen activated protein kinase 3	0.1672	1	1
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage dependent calcium channel	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-dependent calcium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Trypanosoma brucei	inositol 1,4,5-trisphosphate receptor	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage gated potassium channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	calcium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily KQT	0.0052	0.0181	0.0181
Brugia malayi	Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Schistosoma mansoni	vesicular amine transporter	0.0052	0.0181	0.0181
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.1672	1	1
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0052	0.0181	0.0181
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Trichomonas vaginalis	CMGC family protein kinase	0.1672	1	1
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0052	0.0181	0.0181
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus granulosus	Potassium voltage gated channel protein Shaw	0.0052	0.0181	0.0181
Echinococcus granulosus	calcium activated potassium channel	0.0067	0.0273	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0052	0.0181	0.0181
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium large conductance calcium activated	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	short transient receptor potential channel 6	0.0052	0.0181	0.0181
Echinococcus granulosus	geminin	0.0194	0.1041	0.1041
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog	0.0052	0.0181	0.0181
Mycobacterium ulcerans	DNA polymerase IV	0.0022	0	0.5
Leishmania major	hypothetical protein, unknown function	0.0052	0.0181	0.0181
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0052	0.0181	0.0181
Brugia malayi	olfactory channel protein osm-9	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Trichomonas vaginalis	CMGC family protein kinase	0.1672	1	1
Echinococcus multilocularis	voltage dependent calcium channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus granulosus	sodium leak channel non selective protein	0.0052	0.0181	0.0181
Schistosoma mansoni	hypothetical protein	0.0194	0.1041	0.1041
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0052	0.0181	0.0181
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0052	0.0181	0.0181
Brugia malayi	Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium channel KvQLT family member kqt 1	0.0052	0.0181	0.0181
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.1672	1	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus granulosus	sodium channel protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0052	0.0181	0.0181
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0022	0	0.5
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0052	0.0181	0.0181
Brugia malayi	Transient-receptor-potential like protein	0.0052	0.0181	0.0181
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.1672	1	1
Echinococcus granulosus	potassium voltage gated channel subfamily A	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0052	0.0181	0.0181
Echinococcus granulosus	transient receptor potential cation channel	0.0052	0.0181	0.0181
Trichomonas vaginalis	CMGC family protein kinase	0.1672	1	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Trypanosoma brucei	protein kinase, putative	0.1672	1	1
Giardia lamblia	Kinase, CMGC MAPK	0.1672	1	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	two pore calcium channel protein 2	0.0052	0.0181	0.0181
Loa Loa (eye worm)	voltage-gated potassium channel	0.0052	0.0181	0.0181
Leishmania major	hypothetical protein, conserved	0.0052	0.0181	0.0181
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0052	0.0181	0.5
Echinococcus granulosus	ryanodine receptor 44f	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated ion channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel KCNQ	0.0052	0.0181	0.0181
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0052	0.0181	0.0181
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.1672	1	1
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0052	0.0181	0.0181
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage gated potassium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0052	0.0181	0.0181
Echinococcus granulosus	mitogen activated protein kinase 3	0.1672	1	1
Brugia malayi	Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily C	0.0052	0.0181	0.0181
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0052	0.0181	0.0181
Schistosoma mansoni	two-pore calcium channel	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Brugia malayi	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	two pore calcium channel protein 1	0.0052	0.0181	0.0181
Loa Loa (eye worm)	ryanodine receptor	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Schistosoma mansoni	inositol 145-trisphosphate receptor	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Brugia malayi	cation channel family protein	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Brugia malayi	cation channel family protein	0.0052	0.0181	0.0181
Brugia malayi	voltage-dependent calcium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	sodium leak channel non selective protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	shaker cognate	0.0052	0.0181	0.0181
Echinococcus multilocularis	transient receptor potential cation channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.1672	1	1
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential channel	0.0052	0.0181	0.0181
Schistosoma mansoni	voltage-gated potassium channel	0.0052	0.0181	0.0181
Mycobacterium ulcerans	DNA polymerase IV	0.0022	0	0.5
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0052	0.0181	0.0181
Echinococcus granulosus	mitogen activated protein kinase	0.1672	1	1
Schistosoma mansoni	transient receptor potential channel 4	0.0052	0.0181	0.0181
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0052	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0181	0.0181
Echinococcus granulosus	shaker cognate	0.0052	0.0181	0.0181
Echinococcus granulosus	hyperpolarization activated cyclic	0.0052	0.0181	0.0181
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.1672	1	1
Loa Loa (eye worm)	voltage-dependent calcium channel	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel protein	0.0052	0.0181	0.0181
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0052	0.0181	0.0181
Echinococcus granulosus	potassium voltage gated channel subfamily C	0.0052	0.0181	0.0181
Echinococcus granulosus	short transient receptor potential channel 6	0.0052	0.0181	0.0181
Echinococcus granulosus	TRP transient receptor potential channel	0.0052	0.0181	0.0181
Schistosoma mansoni	transient receptor potential channel	0.0052	0.0181	0.0181
Echinococcus granulosus	voltage dependent calcium channel	0.0052	0.0181	0.0181
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.0052	0.0181	0.0181

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 0.7 nM	Agonist activity at human recombinant S1P1 receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding preincubated for 30 mins followed by [35S]GTPgammaS addition measured after 1 hr by topcount scintillation counting analysis	ChEMBL.	24266709
EC50 (functional)	= 65.3 nM	Agonist activity at human recombinant S1P3 receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding preincubated for 30 mins followed by [35S]GTPgammaS addition measured after 1 hr by topcount scintillation counting analysis	ChEMBL.	24266709

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: CHEMBL3105249

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1817867