Showing entry for Synepherine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0004119
Compound NameSynepherine
Structure
FormulaC9H13NO2
InchiKeyYRCWQPVGYLYSOX-UHFFFAOYSA-N
SMILESCNCC(O)C1=CC=C(O)C=C1
InchiInChI=1S/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3
IUPAC4-[1-hydroxy-2-(methylamino)ethyl]phenol
Molecular Weight167.21
Pubchem Id7172
Chembl IdCHEMBL33720
Targets of Information Source
DrugBank DB09203
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
P35348 BXGT009814 Alpha-1A adrenergic receptor reviewed G-protein coupled receptor ADRA1A experimental -
P35368 BXGT009822 Alpha-1B adrenergic receptor reviewed G-protein coupled receptor ADRA1B experimental -
P25100 BXGT009017 Alpha-1D adrenergic receptor reviewed G-protein coupled receptor ADRA1D experimental -
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB 50102660
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT020422 Neuromedin-U receptor 2 reviewed G-protein coupled receptor NMUR2 - - - 6600
CHEMBL CHEMBL33720
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P40225 BXGT010168 Thrombopoietin reviewed - THPO Potency '=' 10000 nM
Q16637 BXGT013646 Survival motor neuron protein reviewed Epigenetic regulator SMN1 Potency '=' 707 nM
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG Potency - 31622 nM
P08482 BXGT006775 Muscarinic acetylcholine receptor M1 reviewed - Chrm1 Potency '=' 1412 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 18887 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 79432 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 22387 nM
P00811 BXGT005666 Beta-lactamase reviewed - ampC Potency '=' 17782 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 22 nM
Q9NR56 BXGT021179 Muscleblind-like protein 1 reviewed Nucleic acid binding MBNL1 Potency - 100000 nM
P08908 BXGT006837 5-hydroxytryptamine receptor 1A reviewed G-protein coupled receptor HTR1A Ki '=' 63000 nM
Q12809 BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 Potency - 22387 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 70794 nM
Q9GZQ4 BXGT020422 Neuromedin-U receptor 2 reviewed G-protein coupled receptor NMUR2 EC50 '=' 6600 nM
P15289 BXGT008102 Arylsulfatase A reviewed Enzyme ARSA Potency - 2685 nM
O95342 BXGT005373 Bile salt export pump reviewed Transporter ABCB11 IC50 '>' 1000000 nM
P51449 BXGT010846 Nuclear receptor ROR-gamma reviewed Nuclear receptor RORC Potency - 2660 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 1778 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 3548 nM
P54132 BXGT011032 Bloom syndrome protein reviewed - BLM Potency '=' 2 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 3981 nM
P10145 BXGT007542 Interleukin-8 reviewed Signaling CXCL8 Potency - 42163 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 11220 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00056 Mandarin orange (Clementine, Tangerine) Citrus reticulata Fruits
BXGF00057 Sweet orange Citrus sinensis Fruits
BXGF00871 Citrus unshiu Citrus unshiu Medicinal Plant
BXGF02106 Citrus medica Citrus medica Medicinal Plant
BXGF02237 Citrus wilsonii Citrus wilsonii Medicinal Plant
BXGF02357 Euodia bodinieri Euodia bodinieri Others
BXGF02635 Ephedra sinica Ephedra sinica Medicinal Plant
BXGF02978 Tetradium ruticarpum Tetradium ruticarpum Medicinal Plant
BXGF03282 Ephedra intermedia Ephedra intermedia Medicinal Plant
BXGF03327 Citrus trifoliata Citrus trifoliata Human Edible Plant
BXGF04564 Ephedra equisetina Ephedra equisetina Medicinal Plant
BXGF04889 Pogostemon cablin Pogostemon cablin Medicinal Plant
BXGF05356 Euodia officinalis Euodia officinalis Others
BXGF05431 Citrus natsudaidai Citrus natsudaidai Human Edible Plant
BXGF05819 Citrus aurantium Citrus aurantium Medicinal Plant
BXGF06002 Euodia ruticarpa Euodia ruticarpa Others
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease