BDBM50318479 (1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalene-1,2-dicarbaldehyde::(1R,8aS)-5,5,8a-Trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1,2-dicarbaldehyde::CHEMBL254550::Polygodial

SMILES CC1(C)CCC[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O

InChI Key InChIKey=AZJUJOFIHHNCSV-KCQAQPDRSA-N

Data  3 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50318479   

TargetTransient receptor potential cation channel subfamily A member 1(Homo sapiens (Human))
Ferrara University

Curated by ChEMBL
LigandPNGBDBM50318479((1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-oc...)
Affinity DataEC50:  59nMAssay Description:Agonist activity at human TRPA1 channel expressed in CHO cells assessed as increase in intracellular calcium levelsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuronal acetylcholine receptor subunit alpha-7(Homo sapiens (Human))
California Northstate University College Of Medicine

Curated by ChEMBL
LigandPNGBDBM50318479((1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-oc...)
Affinity DataIC50: >1.00E+5nMAssay Description:Antagonist activity at human alpha7 nAChR expressed in HEK293 cells assessed as inhibition of (+/-)-epibatidine-induced calcium influx preincubated f...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuronal acetylcholine receptor subunit alpha-3/beta-4(Homo sapiens (Human))
California Northstate University College Of Medicine

Curated by ChEMBL
LigandPNGBDBM50318479((1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-oc...)
Affinity DataIC50:  4.82E+4nMAssay Description:Antagonist activity at human alpha3beta4 nAChR expressed in HEK293 cells assessed as inhibition of (+/-)-epibatidine-induced calcium influx preincuba...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Homo sapiens (Human))
California Northstate University College Of Medicine

Curated by ChEMBL
LigandPNGBDBM50318479((1R,4aS,8aS)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-oc...)
Affinity DataIC50:  6.25E+4nMAssay Description:Antagonist activity at human alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (+/-)-epibatidine-induced calcium influx preincuba...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed