Showing entry for Visnagin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0024929
Compound NameVisnagin
Structure
FormulaC13H10O4
InchiKeyNZVQLVGOZRELTG-UHFFFAOYSA-N
SMILESCOc1c2c(=O)cc(oc2cc2c1cco2)C
InchiInChI=1S/C13H10O4/c1-7-5-9(14)12-11(17-7)6-10-8(3-4-16-10)13(12)15-2/h3-6H,1-2H3
IUPAC4-methoxy-7-methylfuro[3,2-g]chromen-5-one
Molecular Weight230.06
Pubchem Id6716
Chembl IdCHEMBL45176
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 50051349
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 BXGT007506 Adenosine receptor A3 reviewed G-protein coupled receptor ADORA3 60256 - - -
reviewed BXGT009437 Adenosine receptor A2a reviewed Adora2a 42658 - - -
reviewed BXGT007506 Adenosine receptor A3 reviewed G-protein coupled receptor ADORA3 60000 - - -
CHEMBL CHEMBL45176
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
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 39810 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 28183 nM
P10828 BXGT007624 Thyroid hormone receptor beta reviewed Nuclear receptor THRB Potency '=' 141253 nM
P28647 BXGT009282 Adenosine receptor A3 reviewed - Adora3 Ratio '=' 2 -
P25099 BXGT009016 Adenosine receptor A1 reviewed - Adora1 Ratio '=' 2 -
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 Potency '=' 3162 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 1995 nM
P25099 BXGT009016 Adenosine receptor A1 reviewed - Adora1 Inhibition '=' 36 %
P30543 BXGT009437 Adenosine receptor A2a reviewed - Adora2a Ki '=' 42400 nM
P29276 BXGT009329 Adenosine receptor A2b reviewed - Adora2b Ki '=' 42400 nM
P0DMS8 BXGT007506 Adenosine receptor A3 reviewed G-protein coupled receptor ADORA3 Ki '=' 60000 nM
P25099 BXGT009016 Adenosine receptor A1 reviewed - Adora1 pKi(uM) - - -
P0DMS8 BXGT007506 Adenosine receptor A3 reviewed G-protein coupled receptor ADORA3 pKi(uM) '=' -1 -
P30543 BXGT009437 Adenosine receptor A2a reviewed - Adora2a pKi(uM) '=' -1 -
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 98 %
O42275 BXGT004559 Acetylcholinesterase reviewed - ache Inhibition '=' 7 %
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 127 %
P81908 BXGT011959 Cholinesterase reviewed - BCHE Inhibition '=' 16 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF04951 Cimicifuga dahurica Cimicifuga dahurica 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