Showing entry for Gamolenic Acid


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0047405
Compound NameGamolenic Acid
Structure
FormulaC18H30O2
InchiKeyVZCCETWTMQHEPK-QNEBEIHSSA-N
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O
InchiInChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-
IUPAC(6Z,9Z,12Z)-octadeca-6,9,12-trienoic acid
Molecular Weight278.22
Pubchem Id5280933
Chembl IdCHEMBL464982
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 50269532
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 BXGT009515 3-oxo-5-alpha-steroid 4-dehydrogenase 2 reviewed Enzyme SRD5A2 - 14000 - -
reviewed BXGT005645 Trypsin reviewed - - >200000 - -
reviewed BXGT007950 Tissue factor reviewed Receptor F3 - 30000 - -
reviewed BXGT004106 Free fatty acid receptor 1 reviewed G-protein coupled receptor FFAR1 - - - 4620
CHEMBL CHEMBL464982
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
Q14191 BXGT013452 Werner syndrome ATP-dependent helicase reviewed Enzyme WRN Potency - 35481 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 50118 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 67015 nM
Q92830 BXGT019379 Histone acetyltransferase KAT2A reviewed - KAT2A Potency - 14125 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 35481 nM
P55212 BXGT011112 Caspase-6 reviewed Enzyme CASP6 AC50 '=' 505 nM
P00761 BXGT005645 Trypsin reviewed - IC50 '>' 200000 nM
Q9Y468 BXGT022270 Lethal(3)malignant brain tumor-like protein 1 reviewed Epigenetic regulator L3MBTL1 Potency '=' 35481 nM
P13726 BXGT007950 Tissue factor reviewed Receptor F3 IC50 '=' 30000 nM
P08709 BXGT006818 Coagulation factor VII reviewed Enzyme F7 IC50 '=' 30000 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 39810 nM
P00811 BXGT005666 Beta-lactamase reviewed - ampC Potency '=' 5011 nM
P31213 BXGT009515 3-oxo-5-alpha-steroid 4-dehydrogenase 2 reviewed Enzyme SRD5A2 IC50 '=' 14000 nM
P25094 BXGT009014 Peripheral myelin protein 22 reviewed - Pmp22 Potency - 3219 nM
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 44668 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 79432 nM
P49798 BXGT010745 Regulator of G-protein signaling 4 reviewed Enzyme modulator RGS4 Potency - 50118 nM
P49327 BXGT010694 Fatty acid synthase reviewed Enzyme FASN Inhibition '=' 41 %
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 50118 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 79432 nM
Q07869 BXGT012945 Peroxisome proliferator-activated receptor alpha reviewed Nuclear receptor PPARA IC50 '=' 270 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 21192 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 39810 nM
P53350 BXGT010984 Serine/threonine-protein kinase PLK1 reviewed Kinase PLK1 Potency - 29934 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 23778 nM
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG IC50 '=' 2200 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 56234 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 30131 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 35481 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 19952 nM
Q03181 BXGT012701 Peroxisome proliferator-activated receptor delta reviewed Nuclear receptor PPARD IC50 '=' 750 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 31622 nM
Q962Y6 BXGT019597 Thioredoxin glutathione reductase unreviewed - TGR Potency '=' 28183 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 70794 nM
P49327 BXGT010694 Fatty acid synthase reviewed Enzyme FASN Inhibition '=' 78 %
O14842 BXGT004106 Free fatty acid receptor 1 reviewed G-protein coupled receptor FFAR1 EC50 '=' 4620 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00153 Radish Raphanus sativus Vegetables
BXGF00880 Stauntonia obovatifoliola Stauntonia obovatifoliola Others
BXGF01390 Delphinium cyphoplectrum Delphinium cyphoplectrum Others
BXGF03376 Notholaena dealbata Notholaena dealbata Others
BXGF03744 Artemisia siversiana Artemisia siversiana Others
BXGF03882 Uvaria klaineana Uvaria klaineana Medicinal Plant
BXGF03927 Viburnum sieboldi Viburnum sieboldi Medicinal Plant
BXGF04075 Amentotaxus yunnanensis Amentotaxus yunnanensis Medicinal Plant
BXGF04096 Vicia sativa Vicia sativa Medicinal Plant
BXGF04106 Salvia przewalskii Salvia przewalskii Medicinal Plant
BXGF04156 Euphorbia retusa Euphorbia retusa Others
BXGF04422 Camptothecium lutescens Camptothecium lutescens Others
BXGF04603 Dioscorea communis Dioscorea communis Medicinal Plant
BXGF05228 Deguelia hatschbachii Deguelia hatschbachii Others
BXGF05297 Isatis tinctoria Isatis tinctoria Medicinal Plant
BXGF05853 Cannabis sativa Cannabis sativa Medicinal Plant
BXGF06143 Persicaria tinctoria Persicaria tinctoria 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