Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | PLEC | Q15149 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5600121 | 0.81 | DRD2 (0.38) | TRPA1BACE1PLECDRD2 | |
| SCHEMBL1503466 | 0.74 | IDO1 (0.35) | BACE1 | |
| SCHEMBL31297749 | 0.70 | ALOX5 (0.41) | BACE1 | |
| SCHEMBL24828 | 0.70 | TRPA1 (0.54) | TRPA1BACE1DRD2 | |
| SCHEMBL5601804 | 0.68 | TRPA1 (0.38) | TRPA1BACE1DRD2 | |
| SCHEMBL5600601 | 0.67 | TRPA1 (0.40) | TRPA1BACE1DRD2 | |
| SCHEMBL608536 | 0.65 | ALDH1A1 (0.50) | BACE1 | |
| SCHEMBL5602865 | 0.65 | HTR2A (0.36) | TRPA1BACE1 | |
| SCHEMBL5602226 | 0.65 | TRPA1 (0.35) | TRPA1BACE1 | |
| SCHEMBL31236949 | 0.65 | NOX1 (0.50) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7276567-B2 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-10-02 | — | — | US | disclosed |
| EP-1735354-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Company Inc. (US) | 2006-12-27 | — | — | EP | disclosed |
| US-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |
| WO-2005105864-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-11-10 | — | — | WO | disclosed |