Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL6257145 | 1.00 | CNR2 (0.38) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL6254964 | 0.76 | CYP3A4 (0.41) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL6252695 | 0.74 | CYP3A4 (0.40) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL3423038 | 0.68 | CYP3A4 (0.44) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL6256010 | 0.68 | CNR2 (0.31) | CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6257038 | 0.67 | CNR2 (0.34) | CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6257035 | 0.67 | CNR2 (0.34) | CNR2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6560084 | 0.65 | CYP3A4 (0.42) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL29516499 | 0.65 | CYP3A4 (0.42) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 | |
| SCHEMBL4006078 | 0.65 | CYP3A4 (0.42) | CNR2CYP3A4CYP2D6CYP2C9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1521758-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | Exxonmobil Chemical Patents Inc. (US) | 2005-04-13 | — | — | EP | disclosed |
| WO-2004007509-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-01-22 | — | — | WO | disclosed |