Showing entry for Bufotenine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0022192
Compound NameBufotenine
Structure
FormulaC12H16N2O
InchiKeyVTTONGPRPXSUTJ-UHFFFAOYSA-N
SMILESCN(CCc1c[nH]c2c1cc(O)cc2)C
InchiInChI=1S/C12H16N2O/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12/h3-4,7-8,13,15H,5-6H2,1-2H3
IUPAC3-[2-(dimethylamino)ethyl]-1H-indol-5-ol
Molecular Weight204.13
Pubchem Id10257
Chembl IdCHEMBL416526
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 50024206
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 BXGT009486 5-hydroxytryptamine receptor 5A reviewed Htr5a 1000 - - -
reviewed BXGT008472 5-hydroxytryptamine receptor 1A reviewed Htr1a 21.38 - - -
reviewed BXGT008472 5-hydroxytryptamine receptor 1A reviewed Htr1a 1023.29 - - -
reviewed BXGT008059 5-hydroxytryptamine receptor 2A reviewed Htr2a 404 - - -
reviewed BXGT008059 5-hydroxytryptamine receptor 2A reviewed Htr2a 182 - - -
reviewed BXGT008059 5-hydroxytryptamine receptor 2A reviewed Htr2a 68 - - -
reviewed BXGT026170 5-hydroxytryptamine receptor 7 reviewed HTR7 19.95 - - -
reviewed BXGT026170 5-hydroxytryptamine receptor 7 reviewed HTR7 95.49 - - -
reviewed BXGT026170 5-hydroxytryptamine receptor 7 reviewed HTR7 21.37 - - -
reviewed BXGT012647 5-hydroxytryptamine receptor 1F reviewed Htr1f 31.62 - - -
reviewed BXGT009531 5-hydroxytryptamine receptor 5B reviewed Htr5b 1584.89 - - -
reviewed BXGT021415 5-hydroxytryptamine receptor 6 reviewed Htr6 100 - - -
reviewed BXGT009486 5-hydroxytryptamine receptor 5A reviewed Htr5a 2900 - - -
reviewed BXGT009532 5-hydroxytryptamine receptor 6 reviewed Htr6 4.46 - - -
reviewed BXGT009532 5-hydroxytryptamine receptor 6 reviewed Htr6 112.2 - - -
reviewed BXGT009239 5-hydroxytryptamine receptor 2A reviewed G-protein coupled receptor HTR2A 15 - - -
reviewed BXGT009239 5-hydroxytryptamine receptor 2A reviewed G-protein coupled receptor HTR2A 145 - - -
reviewed BXGT008059 5-hydroxytryptamine receptor 2A reviewed Htr2a 380 - - -
reviewed BXGT008472 5-hydroxytryptamine receptor 1A reviewed Htr1a 259 - - -
reviewed BXGT009255 5-hydroxytryptamine receptor 2C reviewed G-protein coupled receptor HTR2C 70 - - -
reviewed BXGT009272 5-hydroxytryptamine receptor 1B reviewed Htr1b 910 - - -
reviewed BXGT009558 Sodium-dependent serotonin transporter reviewed Transporter SLC6A4 - 1200 - -
reviewed BXGT004559 Acetylcholinesterase reviewed ache - 11400 - -
CHEMBL CHEMBL416526
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
P19327 BXGT008472 5-hydroxytryptamine receptor 1A reviewed - Htr1a Ki '=' 25 nM
P28223 BXGT009239 5-hydroxytryptamine receptor 2A reviewed G-protein coupled receptor HTR2A p[A50] '=' 6 -
Q9ES14 BXGT020314 Gamma-aminobutyric acid receptor subunit epsilon reviewed - Gabre Ki '>' 100000 nM
Q91ZM7 BXGT019327 GABA theta subunit unreviewed - Gabrq Ki '>' 100000 nM
P63138 BXGT011502 Gamma-aminobutyric acid receptor subunit beta-2 reviewed - Gabrb2 Ki '>' 100000 nM
P63079 BXGT011491 Gamma-aminobutyric acid receptor subunit beta-3 reviewed - Gabrb3 Ki '>' 100000 nM
P62813 BXGT011460 Gamma-aminobutyric acid receptor subunit alpha-1 reviewed - Gabra1 Ki '>' 100000 nM
P30191 BXGT009410 Gamma-aminobutyric acid receptor subunit alpha-6 reviewed - Gabra6 Ki '>' 100000 nM
P28473 BXGT009261 Gamma-aminobutyric acid receptor subunit gamma-3 reviewed - Gabrg3 Ki '>' 100000 nM
P28471 BXGT009259 Gamma-aminobutyric acid receptor subunit alpha-4 reviewed - Gabra4 Ki '>' 100000 nM
P23576 BXGT008885 Gamma-aminobutyric acid receptor subunit alpha-2 reviewed - Gabra2 Ki '>' 100000 nM
P23574 BXGT008884 Gamma-aminobutyric acid receptor subunit gamma-1 reviewed - Gabrg1 Ki '>' 100000 nM
P20236 BXGT008551 Gamma-aminobutyric acid receptor subunit alpha-3 reviewed - Gabra3 Ki '>' 100000 nM
P19969 BXGT008536 Gamma-aminobutyric acid receptor subunit alpha-5 reviewed - Gabra5 Ki '>' 100000 nM
P18508 BXGT008412 Gamma-aminobutyric acid receptor subunit gamma-2 reviewed - Gabrg2 Ki '>' 100000 nM
P18506 BXGT008410 Gamma-aminobutyric acid receptor subunit delta reviewed - Gabrd Ki '>' 100000 nM
P15431 BXGT008122 Gamma-aminobutyric acid receptor subunit beta-1 reviewed - Gabrb1 Ki '>' 100000 nM
O09028 BXGT004049 Gamma-aminobutyric acid receptor subunit pi reviewed - Gabrp Ki '>' 100000 nM
P28335 BXGT009255 5-hydroxytryptamine receptor 2C reviewed G-protein coupled receptor HTR2C Ki '=' 70 nM
P32305 BXGT009621 5-hydroxytryptamine receptor 7 reviewed - Htr7 Increase - - -
P14842 BXGT008059 5-hydroxytryptamine receptor 2A reviewed - Htr2a Ki '=' 380 nM
P08909 BXGT006838 5-hydroxytryptamine receptor 2C reviewed - Htr2c Ki '=' 380 nM
P30994 BXGT009493 5-hydroxytryptamine receptor 2B reviewed - Htr2b Ki '=' 380 nM
P19327 BXGT008472 5-hydroxytryptamine receptor 1A reviewed - Htr1a Ki '=' 259 nM
P28565 BXGT009273 5-hydroxytryptamine receptor 1D reviewed - Htr1d Kd '=' 38 nM
P19327 BXGT008472 5-hydroxytryptamine receptor 1A reviewed - Htr1a Kd '=' 38 nM
P30940 BXGT009484 5-hydroxytryptamine receptor 1F reviewed - Htr1f Kd '=' 38 nM
P28564 BXGT009272 5-hydroxytryptamine receptor 1B reviewed - Htr1b Kd '=' 38 nM
P31645 BXGT009558 Sodium-dependent serotonin transporter reviewed Transporter SLC6A4 IC50 '=' 1200 nM
P28564 BXGT009272 5-hydroxytryptamine receptor 1B reviewed - Htr1b Ki '=' 910 nM
P08908 BXGT006837 5-hydroxytryptamine receptor 1A reviewed G-protein coupled receptor HTR1A Kd '=' 3 nM
P28221 BXGT009237 5-hydroxytryptamine receptor 1D reviewed G-protein coupled receptor HTR1D p[A50] '=' 7 -
P28221 BXGT009237 5-hydroxytryptamine receptor 1D reviewed G-protein coupled receptor HTR1D Intrinsic activity '=' 0 -
P32305 BXGT009621 5-hydroxytryptamine receptor 7 reviewed - Htr7 Ki '=' 7 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 22387 nM
O42275 BXGT004559 Acetylcholinesterase reviewed - ache IC50 '=' 11400 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00862 Phebalium ozothamnoides Phebalium ozothamnoides Others
BXGF00977 Vitex megapotamica Vitex megapotamica Human Edible Plant
BXGF01266 Dysoxylum lenticellatum Dysoxylum lenticellatum Others
BXGF01284 Saururus cernuus Saururus cernuus Medicinal Plant
BXGF01343 Strychnos fendleri Strychnos fendleri Others
BXGF01466 Halimeda macroloba Halimeda macroloba Others
BXGF01510 Cabucala madagascariensis Cabucala madagascariensis Others
BXGF02702 Arundo donax Arundo donax Medicinal Plant
BXGF02723 Hesperocyparis macrocarpa Hesperocyparis macrocarpa Others
BXGF02848 Buxus sempervirens Buxus sempervirens Medicinal Plant
BXGF03270 Aruncus dioicus Aruncus dioicus Medicinal Plant
BXGF03442 Rhaponticum carthamoides Rhaponticum carthamoides Medicinal Plant
BXGF03924 Kochia trichophylla Kochia trichophylla Others
BXGF04191 Vicia villosa Vicia villosa Medicinal Plant
BXGF04830 Artemisia oranensis Artemisia oranensis Others
BXGF05193 Piper futokadsura Piper futokadsura Others
BXGF05692 Potentilla multifida Potentilla multifida Medicinal Plant
BXGF05859 Haplopappus venetus Haplopappus venetus Others
BXGF05925 Centaurea amara Centaurea amara 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