Showing entry for Lycorine



                             
General Compound Information
BXGC IdBXGC0023640
Compound NameLycorine
Structure
FormulaC16H17NO4
InchiKeyXGVJWXAYKUHDOO-DANNLKNASA-N
SMILESO[C@H]1C=C2CCN3[C@H]2[C@@H]([C@@H]1O)c1cc2OCOc2cc1C3
InchiInChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1
IUPAC
Molecular Weight287.12
Pubchem Id72378
Chembl IdCHEMBL400092
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 50221066
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 BXGT011959 Cholinesterase reviewed BCHE - >200000 - -
reviewed BXGT004559 Acetylcholinesterase reviewed ache - >200000 - -
reviewed BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE - 155000 - -
CHEMBL CHEMBL400092
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
P11387 BXGT007696 DNA topoisomerase 1 reviewed Enzyme TOP1 Inhibition - - -
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 Ki - - -
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 10000 nM
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 60 %
P49798 BXGT010745 Regulator of G-protein signaling 4 reviewed Enzyme modulator RGS4 Potency - 4744 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE Ki - - -
P11388 BXGT007697 DNA topoisomerase 2-alpha reviewed - TOP2A Inhibition - - -
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '=' 155000 nM
Q16637 BXGT013646 Survival motor neuron protein reviewed Epigenetic regulator SMN1 Potency '=' 1122 nM
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 97 %
O42275 BXGT004559 Acetylcholinesterase reviewed - ache IC50 '>' 200000 nM
P81908 BXGT011959 Cholinesterase reviewed - BCHE IC50 '>' 200000 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '>' 200000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01458 Ligularia altaica Ligularia altaica Others
BXGF01558 Ferula persica Ferula persica Medicinal Plant
BXGF01666 Helichrysum asperum Helichrysum asperum Medicinal Plant
BXGF01703 Dalbergia candenatensis Dalbergia candenatensis Medicinal Plant
BXGF02466 Ligularia przewalskii Ligularia przewalskii Others
BXGF02651 Searsia leptodictya Searsia leptodictya Human Edible Plant
BXGF02696 Lophopetalum toxicum Lophopetalum toxicum Others
BXGF02919 Stachys aegyptiaca Stachys aegyptiaca Others
BXGF03032 Anthoceros punctatus Anthoceros punctatus Others
BXGF03266 Elaeocarpus sphaericus Elaeocarpus sphaericus Human Edible Plant
BXGF03372 Lupinus holosericeus Lupinus holosericeus Others
BXGF03385 Cinchona officinalis Cinchona officinalis Medicinal Plant
BXGF03409 Datura wrightii Datura wrightii Others
BXGF03585 Angelica hirsutiflora Angelica hirsutiflora Others
BXGF03595 Clausena suffruticosa Clausena suffruticosa Others
BXGF03617 Crinum yemense Crinum yemense Others
BXGF05066 amaryllidaceae amaryllidaceae Others
BXGF05299 Corynandra viscosa Corynandra viscosa Medicinal Plant
BXGF06260 Dryopteris dilatata Dryopteris dilatata 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