Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 4/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6253061 | 0.90 | CYP1A1 (0.49) | CYP1A1ALDH1A1KDM4EHPGDAHR | |
| SCHEMBL6255703 | 0.82 | AHR (0.36) | CYP1A1AHR | |
| SCHEMBL5587181 | 0.77 | CYP1A1 (0.41) | CYP1A1ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL6256853 | 0.76 | AHR (0.57) | CYP1A1ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL5590203 | 0.75 | CA1 (0.30) | — | |
| SCHEMBL6252702 | 0.75 | ALDH1A1 (0.39) | CYP1A1ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL4374579 | 0.74 | AHR (0.50) | ALDH1A1AHR | |
| SCHEMBL30927166 | 0.74 | AHR (0.50) | ALDH1A1AHR | |
| SCHEMBL5588453 | 0.68 | — | — | |
| SCHEMBL5588428 | 0.68 | CA1 (0.30) | — |
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 |