Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.44 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12023698 | 0.82 | ABCC4 (0.44) | GPR84FFAR1MAPTPPARDALDH1A1 | |
| SCHEMBL8926617 | 0.81 | MAPT (0.38) | MAPTALDH1A1 | |
| SCHEMBL13246467 | 0.81 | GPR84 (0.50) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL1716771 | 0.80 | ALDH1A1 (0.46) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL715220 | 0.79 | GPR84 (0.50) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL302569 | 0.77 | GPR84 (0.53) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL743054 | 0.77 | GPR84 (0.53) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL16670773 | 0.77 | GPR84 (0.53) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL322629 | 0.77 | GPR84 (0.53) | ACE2GPR84FFAR1MAPTLCK | |
| SCHEMBL324704 | 0.77 | GPR84 (0.53) | ACE2GPR84FFAR1MAPTLCK |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5599960-A | UNSATURATED ESTERS AS INTERMEDIATES FOR FURANONE ORGANOLEPTICS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1997-02-04 | — | — | US | disclosed |
| US-5583237-A | CATALYTICALLY REACTING 2,7-OCTADIENOL/1-/ WITH TRIALKYL ORTHOPROPIONATE IN PRESENCE OF LEWIS ACID YIELDS ALKYL ESTER WHICH IS SAPONIFIED, HYDROLYZED AND DISTILLED, THEN LACTONIZATION AND ISOLATION | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1996-12-10 | — | — | US | disclosed |