TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 170.252 | Formula: C9H18N2O
H donors: 1 H acceptors: 0 LogP: 2.03 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: C[C@@H]1OC(=N[C@H]1CCCCC)N
InChi: 1S/C9H18N2O/c1-3-4-5-6-8-7(2)12-9(10)11-8/h7-8H,3-6H2,1-2H3,(H2,10,11)/t7-,8-/m0/s1
InChiKey: BUDMJYOFRMUMSR-YUMQZZPRSA-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
Mus musculus	nitric oxide synthase 2, inducible	Starlite/ChEMBL	References
Mus musculus	nitric oxide synthase 1, neuronal	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
Trichomonas vaginalis	sulfite reductase, putative	0.0059	0.001	0.0804
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0136	0.0127	0.0117
Echinococcus granulosus	TRP transient receptor potential channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage gated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	calcium activated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage gated hydrogen channel 1	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog	0.0136	0.0127	0.0117
Echinococcus multilocularis	two pore calcium channel protein 1	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog	0.0136	0.0127	0.0117
Echinococcus granulosus	hyperpolarization activated cyclic	0.0136	0.0127	0.0117
Schistosoma mansoni	solute carrier family 33 (acetyl-CoA transporter	0.2469	0.3668	0.3661
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Brugia malayi	voltage-dependent calcium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Schistosoma mansoni	60S ribosomal protein L21	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.2104	0.3114	0.3107
Echinococcus granulosus	voltage dependent calcium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0136	0.0127	0.0117
Echinococcus multilocularis	short transient receptor potential channel 6	0.0136	0.0127	0.0117
Echinococcus granulosus	ryanodine receptor 44f	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Loa Loa (eye worm)	voltage-gated calcium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.6642	1	1
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.2104	0.3114	1
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0136	0.0127	0.0117
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0136	0.0127	0.0117
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0136	0.0127	0.0117
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog	0.0136	0.0127	0.0117
Giardia lamblia	Nitric oxide synthase, inducible	0.0052	0	0.5
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0136	0.0127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated cation channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent calcium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential channel 4	0.0136	0.0127	0.0117
Schistosoma mansoni	inositol 145-trisphosphate receptor	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily KQT	0.0136	0.0127	0.0117
Plasmodium vivax	NADPH-cytochrome p450 reductase, putative	0.0059	0.001	1
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0136	0.0127	1
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	ryanodine receptor	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily C	0.0136	0.0127	0.0117
Echinococcus multilocularis	shaker cognate	0.0136	0.0127	0.0117
Echinococcus granulosus	two pore calcium channel protein 2	0.0136	0.0127	0.0117
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	ryanodine receptor 44f	0.0136	0.0127	0.0117
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0136	0.0127	0.5
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Giardia lamblia	Hypothetical protein	0.0052	0	0.5
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated calcium channel, alpha subunit	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel KCNQ	0.0136	0.0127	0.0117
Echinococcus granulosus	short transient receptor potential channel 6	0.0136	0.0127	0.0117
Plasmodium falciparum	acetyl-CoA transporter, putative	0.6642	1	1
Brugia malayi	Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0136	0.0127	0.0117
Echinococcus multilocularis	transfer RNA-Gly	0.0136	0.0127	0.0117
Loa Loa (eye worm)	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium large conductance calcium activated	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	solute carrier family 33 (acetyl-CoA transporter	0.6642	1	1
Schistosoma mansoni	calcium channel voltage-dependent p/q type alpha 1a-related	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Toxoplasma gondii	Acetyl-coenzyme A transporter, putative	0.6642	1	1
Echinococcus multilocularis	potassium voltage gated channel subfamily A	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated ion channel	0.0136	0.0127	0.0117
Mycobacterium ulcerans	formate dehydrogenase H FdhF	0.0059	0.001	0.5
Brugia malayi	Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage gated potassium channel	0.0136	0.0127	0.0117
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0136	0.0127	0.0117
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	calcium-activated potassium channel	0.0136	0.0127	0.0117
Onchocerca volvulus	Transient receptor potential cation channel trpm homolog	0.0136	0.0127	0.5
Schistosoma mansoni	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Leishmania major	hypothetical protein, unknown function	0.0136	0.0127	0.0408
Echinococcus multilocularis	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential gamma protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	conserved hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus granulosus	sodium leak channel non selective protein	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	two pore calcium channel protein 1	0.0136	0.0127	0.0117
Schistosoma mansoni	ryanodine receptor related	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily A	0.0136	0.0127	0.0117
Leishmania major	hypothetical protein, conserved	0.0136	0.0127	0.0408
Echinococcus granulosus	calcium activated potassium channel	0.0136	0.0127	0.0117
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.0136	0.0127	1
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	two-pore calcium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Brugia malayi	ion channel NompC	0.0136	0.0127	0.0117
Brugia malayi	Protein C21B10.09 in chromosome II	0.6642	1	1
Echinococcus granulosus	potassium channel KvQLT family member kqt 1	0.0136	0.0127	0.0117
Echinococcus multilocularis	sodium channel protein	0.2104	0.3114	0.3107
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily C	0.0136	0.0127	0.0117
Echinococcus granulosus	hypothetical protein	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Echinococcus granulosus	shaker cognate	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential gamma protein	0.0136	0.0127	0.0117
Brugia malayi	Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog	0.0136	0.0127	0.0117
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0136	0.0127	0.0117
Brugia malayi	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	solute carrier family 33	0.6642	1	1
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	vesicular amine transporter	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Leishmania major	NADPH-cytochrome p450 reductase-like protein	0.0059	0.001	0.0033
Brugia malayi	cation channel family protein	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Trypanosoma brucei	inositol 1,4,5-trisphosphate receptor	0.0136	0.0127	1
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	ion channel NompC	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Loa Loa (eye worm)	calcium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	two pore calcium channel protein 2	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage gated hydrogen channel 1	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium large conductance calcium activated	0.0136	0.0127	0.0117
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential cation channel subfamily m member	0.0136	0.0127	0.0117
Echinococcus granulosus	hyperpolarization activated cyclic	0.0136	0.0127	0.0117
Echinococcus granulosus	sodium channel protein	0.2104	0.3114	0.3107
Brugia malayi	cation channel family protein	0.0136	0.0127	0.0117
Brugia malayi	olfactory channel protein osm-9	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0136	0.0127	0.0117
Echinococcus granulosus	transient receptor potential cation channel	0.0136	0.0127	0.0117
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily D	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	short transient receptor potential channel 6	0.0136	0.0127	0.0117
Schistosoma mansoni	solute carrier family 33 (acetyl-CoA transporter	0.6642	1	1
Echinococcus multilocularis	transient receptor potential cation channel	0.0136	0.0127	0.0117
Brugia malayi	Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog	0.0136	0.0127	0.0117
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0136	0.0127	0.0117
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	transient receptor potential channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	voltage dependent calcium channel	0.0136	0.0127	0.0117
Brugia malayi	Transient-receptor-potential like protein	0.0136	0.0127	0.0117
Echinococcus granulosus	solute carrier family 33	0.6642	1	1
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus granulosus	Potassium voltage gated channel protein Shaw	0.0136	0.0127	0.0117
Loa Loa (eye worm)	voltage-gated potassium channel	0.0136	0.0127	0.0117
Leishmania major	p450 reductase, putative	0.0059	0.001	0.0033
Onchocerca volvulus		0.0136	0.0127	0.5
Loa Loa (eye worm)	voltage-dependent calcium channel	0.0136	0.0127	0.0117
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.0136	0.0127	1
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	sodium leak channel non selective protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0136	0.0127	0.0117
Trypanosoma cruzi	inositol 1,4,5-trisphosphate receptor, putative	0.0136	0.0127	1
Brugia malayi	Ryanodine Receptor TM 4-6 family protein	0.0136	0.0127	0.0117
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0136	0.0127	0.0117
Echinococcus multilocularis	voltage dependent calcium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel protein	0.0136	0.0127	0.0117
Echinococcus multilocularis	short transient receptor potential channel 6	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-dependent calcium channel	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0136	0.0127	0.0117
Schistosoma mansoni	voltage-gated potassium channel	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0136	0.0127	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0136	0.0127	0.0117

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.5 uM	Inhibition of inducible nitric oxide synthase (iNOS) in mice	ChEMBL.	14698148
IC50 (binding)	= 0.5 uM	Inhibition of inducible nitric oxide synthase (iNOS) in mice	ChEMBL.	14698148
IC50 (binding)	= 0.79 uM	Inhibition of neuronal nitric oxide synthase (nNOS) in mice	ChEMBL.	14698148
IC50 (binding)	= 0.79 uM	Inhibition of neuronal nitric oxide synthase (nNOS) in mice	ChEMBL.	14698148
Selectivity (binding)	= 1.6	Selectivity ratio of IC50 of nNOS to IC50 of iNOS	ChEMBL.	14698148

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: CHEMBL320547

Bibliographic References

1 literature reference was collected for this gene.

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

Detailed information for compound 177655