Showing entry for 6-Methoxy-2-Methyl-3,4-Dihydro-1H-Isoquinolin-7-Ol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0016637
Compound Name6-Methoxy-2-Methyl-3,4-Dihydro-1H-Isoquinolin-7-Ol
Structure
FormulaC11H15NO2
InchiKeyFELOSQQXIHRUSH-UHFFFAOYSA-N
SMILESCOc1cc2CCN(Cc2cc1O)C
InchiInChI=1S/C11H15NO2/c1-12-4-3-8-6-11(14-2)10(13)5-9(8)7-12/h5-6,13H,3-4,7H2,1-2H3
IUPAC6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
Molecular Weight193.11
Pubchem Id280225
Chembl IdCHEMBL593001
Targets of Information Source
DrugBank n.a
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
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 50006640
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 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed Chrna4 1700 - - -
reviewed BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed Chrna4 100000 - - -
reviewed BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed Chrna3 300000 - - -
reviewed BXGT020309 Neuronal acetylcholine receptor subunit beta-2 reviewed Chrnb2 - 4400 - -
reviewed BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed Chrna3 - >1000000 - -
CHEMBL CHEMBL593001
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
Q8R493 BXGT018685 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 IC50 '=' 4400 nM
Q9ERK7 BXGT020309 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 IC50 '=' 4400 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 Ki '=' 100000 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 Ki '=' 100000 nM
P53686 BXGT011011 NAD-dependent protein deacetylase HST2 reviewed - HST2 Activity '=' 100 %
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 Ki '=' 1700 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 Ki '=' 1700 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 Ki '=' 300000 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 Ki '=' 300000 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 IC50 '>' 1000000 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 IC50 '>' 1000000 nM
P36544 BXGT009926 Neuronal acetylcholine receptor subunit alpha-7 reviewed - CHRNA7 IC50 '>' 100000 nM
P53686 BXGT011011 NAD-dependent protein deacetylase HST2 reviewed - HST2 Activity '=' 98 %
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 IC50 '=' 100000 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 IC50 '=' 100000 nM
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 Inhibition - - -
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 Inhibition - - -
P36544 BXGT009926 Neuronal acetylcholine receptor subunit alpha-7 reviewed - CHRNA7 EC50 '>' 100000 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 Ki '=' 100000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01052 Artabotrys maingayi Artabotrys maingayi Medicinal Plant
BXGF02254 Thuja plicata Thuja plicata Medicinal Plant
BXGF03159 Coleonema pulchellum Coleonema pulchellum Others
BXGF03382 Tamarix chinensis Tamarix chinensis Medicinal Plant
BXGF03464 Senna spectabilis Senna spectabilis Medicinal Plant
BXGF03612 Symphytum officinale Symphytum officinale Medicinal Plant
BXGF03764 Psacalium peltatum Psacalium peltatum Medicinal Plant
BXGF03830 Diospyros ebenum Diospyros ebenum Medicinal Plant
BXGF03888 Angelica dahurica Angelica dahurica Medicinal Plant
BXGF03971 Corydalis ophiocarpa Corydalis ophiocarpa Medicinal Plant
BXGF04006 Corydalis ternata Corydalis ternata Others
BXGF04055 Teclea sudanica Teclea sudanica Others
BXGF04063 Mezzettia leptopoda Mezzettia leptopoda Others
BXGF04119 Stachys plumosa Stachys plumosa Others
BXGF04178 Piper methysticum Piper methysticum Medicinal Plant
BXGF04190 Lappula echinata Lappula echinata Medicinal Plant
BXGF04237 Ligularia sagitta Ligularia sagitta Medicinal Plant
BXGF04632 Corydalis pallida Corydalis pallida Medicinal Plant
BXGF04806 Ulex airensis Ulex airensis Others
BXGF04873 Papaver bracteatum Papaver bracteatum Medicinal Plant
BXGF05074 Chaetomorpha moniligera Chaetomorpha moniligera 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