☰
 

SMILES:
C=CCOC(=O)CCC1CCCCC1

Aroma Description:
sweet, pineapple, tropical, fruity, candy, waxy, apple, green1

Receptor Expression log10 EC50 Adj. Top Antagonist? Correlated Perceptual Qualities
OR1D2 100 -4.19 2 -  rose, citrus, fresh, sweet, floral, waxy, fatty, bois_de_rose, peach, blueberry
OR2W1 53 - -0.1626 3   
OR5K1 100 - -0.1626 3   
OR8H1 88 - -0.1626 3   
 

SMILES:
C=CCOC(=O)CCC1CCCCC1

Aroma Description:
sweet, pineapple, tropical, fruity, candy, waxy, apple, green

Receptor Expr.% Agonist? Dock Score Known agonist Correlated Perceptual Qualities

Dock Score is a measure of how strongly the algorithm thinks the odorant is likely to be an agonist of the receptor.
Receptors in italics are "orphans", i.e. receptors whose agonists have not been identified experimentally.

1.) The Good Scents Company

2.) Veithen, A.; Wilin, F.; Philippeau, M.; Chatelain, P. OR1D2 is a broadly tuned human olfactory receptor. Chem. Senses 2015, 40, 262–263.

3.) Aya Kato, Naoko Saito (2015) Odor control agent. JP5798382B2
×
 
 

Code version:
 

Docker used:
 

Files:
Active model: text 3D download
Inactive model: text 3D download
Active dock: text 3D download
Inactive dock: text 3D download
JSON entry: text   download