Showing entry for (-)-Lobeline


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0038169
Compound Name(-)-Lobeline
Structure
FormulaC22H27NO2
InchiKeyMXYUKLILVYORSK-HBMCJLEFSA-N
SMILESO[C@H](c1ccccc1)C[C@@H]1CCC[C@@H](N1C)CC(=O)c1ccccc1
InchiInChI=1S/C22H27NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-21,24H,8,13-16H2,1H3/t19-,20+,21-/m0/s1
IUPAC2-[(2R,6S)-6-[(2S)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethanone
Molecular Weight337.2
Pubchem Id101616
Chembl IdCHEMBL122270
Targets of Information Source
DrugBank DB05137
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
Q9UGM1 BXGT021686 Neuronal acetylcholine receptor subunit alpha-9 reviewed Ion channel CHRNA9 investigational -
Q9GZZ6 BXGT020429 Neuronal acetylcholine receptor subunit alpha-10 reviewed Ion channel CHRNA10 investigational -
P36544 BXGT009926 Neuronal acetylcholine receptor subunit alpha-7 reviewed - CHRNA7 investigational -
PDB L0B
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
I6L8L2 BXGT003689 Achbp unreviewed - 0.29 - - -
Binding DB 50080818
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 BXGT012620 Synaptic vesicular amine transporter reviewed Slc18a2 4 - - -
reviewed BXGT012620 Synaptic vesicular amine transporter reviewed Slc18a2 6260 - - -
reviewed BXGT012620 Synaptic vesicular amine transporter reviewed Slc18a2 2760 - - -
reviewed BXGT012847 Neuronal acetylcholine receptor subunit alpha-7 reviewed Chrna7 6260 - - -
reviewed BXGT010407 Neuronal acetylcholine receptor subunit alpha-4 reviewed Ion channel CHRNA4 5.01 - - -
reviewed BXGT011224 Acetylcholine-binding protein reviewed - 630.96 - - -
reviewed BXGT009926 Neuronal acetylcholine receptor subunit alpha-7 reviewed CHRNA7 7943.28 - - -
CHEMBL CHEMBL122270
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
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 Ki '=' 40 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 Ki '=' 40 nM
P43681 BXGT010407 Neuronal acetylcholine receptor subunit alpha-4 reviewed Ion channel CHRNA4 Ki '=' 5 nM
P17787 BXGT008341 Neuronal acetylcholine receptor subunit beta-2 reviewed Ion channel CHRNB2 Ki '=' 5 nM
O15296 BXGT004148 Arachidonate 15-lipoxygenase B reviewed Enzyme ALOX15B Potency - 35481 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 22387 nM
Q01827 BXGT012620 Synaptic vesicular amine transporter reviewed - Slc18a2 Ki '=' 470 nM
Q05941 BXGT012847 Neuronal acetylcholine receptor subunit alpha-7 reviewed - Chrna7 Ki '=' 4 nM
P20420 BXGT008572 Neuronal acetylcholine receptor subunit alpha-5 reviewed - Chrna5 Ki '=' 4 nM
P43143 BXGT010361 Neuronal acetylcholine receptor subunit alpha-6 reviewed - Chrna6 Ki '=' 4 nM
P12391 BXGT007811 Neuronal acetylcholine receptor subunit beta-3 reviewed - Chrnb3 Ki '=' 4 nM
Q9JLB5 BXGT020832 Neuronal acetylcholine receptor subunit alpha-10 reviewed - Chrna10 Ki '=' 4 nM
P43144 BXGT010362 Neuronal acetylcholine receptor subunit alpha-9 reviewed - Chrna9 Ki '=' 4 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 Ki '=' 4 nM
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 Ki '=' 4 nM
P12389 BXGT007809 Neuronal acetylcholine receptor subunit alpha-2 reviewed - Chrna2 Ki '=' 4 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 Ki '=' 4 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 Ki '=' 4 nM
Q01827 BXGT012620 Synaptic vesicular amine transporter reviewed - Slc18a2 Ki '=' 2760 nM
P58154 BXGT011224 Acetylcholine-binding protein reviewed - Ki '=' 630 nM
Q01827 BXGT012620 Synaptic vesicular amine transporter reviewed - Slc18a2 Ki '=' 4 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29092 nM
P36544 BXGT009926 Neuronal acetylcholine receptor subunit alpha-7 reviewed - CHRNA7 Ki '=' 7943 nM
Q01827 BXGT012620 Synaptic vesicular amine transporter reviewed - Slc18a2 Ki '=' 6260 nM
Q8WSF8 BXGT018982 Soluble acetylcholine receptor unreviewed - Ki '=' 2 nM
Q05941 BXGT012847 Neuronal acetylcholine receptor subunit alpha-7 reviewed - Chrna7 Ki '=' 6260 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 631 nM
Q05941 BXGT012847 Neuronal acetylcholine receptor subunit alpha-7 reviewed - Chrna7 IC50 '=' 18100 nM
P20420 BXGT008572 Neuronal acetylcholine receptor subunit alpha-5 reviewed - Chrna5 IC50 '=' 18100 nM
P43143 BXGT010361 Neuronal acetylcholine receptor subunit alpha-6 reviewed - Chrna6 IC50 '=' 18100 nM
P12391 BXGT007811 Neuronal acetylcholine receptor subunit beta-3 reviewed - Chrnb3 IC50 '=' 18100 nM
Q9JLB5 BXGT020832 Neuronal acetylcholine receptor subunit alpha-10 reviewed - Chrna10 IC50 '=' 18100 nM
P43144 BXGT010362 Neuronal acetylcholine receptor subunit alpha-9 reviewed - Chrna9 IC50 '=' 18100 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 IC50 '=' 18100 nM
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 IC50 '=' 18100 nM
P12389 BXGT007809 Neuronal acetylcholine receptor subunit alpha-2 reviewed - Chrna2 IC50 '=' 18100 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 IC50 '=' 18100 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 IC50 '=' 18100 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 25118 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 631 nM
Q05941 BXGT012847 Neuronal acetylcholine receptor subunit alpha-7 reviewed - Chrna7 IC50 '=' 87 nM
P20420 BXGT008572 Neuronal acetylcholine receptor subunit alpha-5 reviewed - Chrna5 IC50 '=' 87 nM
P43143 BXGT010361 Neuronal acetylcholine receptor subunit alpha-6 reviewed - Chrna6 IC50 '=' 87 nM
P12391 BXGT007811 Neuronal acetylcholine receptor subunit beta-3 reviewed - Chrnb3 IC50 '=' 87 nM
Q9JLB5 BXGT020832 Neuronal acetylcholine receptor subunit alpha-10 reviewed - Chrna10 IC50 '=' 87 nM
P43144 BXGT010362 Neuronal acetylcholine receptor subunit alpha-9 reviewed - Chrna9 IC50 '=' 87 nM
P12392 BXGT007812 Neuronal acetylcholine receptor subunit beta-4 reviewed - Chrnb4 IC50 '=' 87 nM
P12390 BXGT007810 Neuronal acetylcholine receptor subunit beta-2 reviewed - Chrnb2 IC50 '=' 87 nM
P12389 BXGT007809 Neuronal acetylcholine receptor subunit alpha-2 reviewed - Chrna2 IC50 '=' 87 nM
P09483 BXGT006896 Neuronal acetylcholine receptor subunit alpha-4 reviewed - Chrna4 IC50 '=' 87 nM
P04757 BXGT006258 Neuronal acetylcholine receptor subunit alpha-3 reviewed - Chrna3 IC50 '=' 87 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 23715 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29855 nM
Q8BRU6 BXGT026111 Synaptic vesicular amine transporter reviewed - Slc18a2 IC50 '=' 381 nM
Q05940 BXGT012846 Synaptic vesicular amine transporter reviewed Transporter SLC18A2 Ki '=' 1950 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 20596 nM
P15289 BXGT008102 Arylsulfatase A reviewed Enzyme ARSA Potency - 47 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 28183 nM
Q05940 BXGT012846 Synaptic vesicular amine transporter reviewed Transporter SLC18A2 Ki '=' 1840 nM
O15648 BXGT004185 ATP-dependent 6-phosphofructokinase reviewed - pfk Potency - 8492 nM
Q05940 BXGT012846 Synaptic vesicular amine transporter reviewed Transporter SLC18A2 IC50 '=' 4200 nM
P28223 BXGT009239 5-hydroxytryptamine receptor 2A reviewed G-protein coupled receptor HTR2A Ki '=' 7400 nM
Q05940 BXGT012846 Synaptic vesicular amine transporter reviewed Transporter SLC18A2 Ki '>' 10000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01617 Campanula medium Campanula medium Medicinal Plant
BXGF01878 Lobelia chinensis Lobelia chinensis Medicinal Plant
BXGF03809 Lobelia inflata Lobelia inflata Medicinal Plant
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