Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 5/20 | 0.43 |
| ▸ | CES2 | O00748 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | CES1 | P23141 | 3/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.31 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6649876 | 0.98 | PAOX (0.40) | PAOXCES2ALDH1A1DGKAACHE | |
| SCHEMBL6649477 | 0.92 | ALDH1A1 (0.38) | PAOXCES2ALDH1A1ACHE | |
| SCHEMBL6651752 | 0.80 | TDP1 (0.35) | ALDH1A1DGKANAAA | |
| SCHEMBL6649697 | 0.79 | PAOX (0.46) | PAOXCES2ALDH1A1DGKAACHE | |
| SCHEMBL14121245 | 0.78 | TBXAS1 (0.39) | ALDH1A1DGKATSHRSLC22A6SLC22A8 | |
| SCHEMBL6651211 | 0.77 | PAOX (0.43) | PAOXCES2ALDH1A1DGKAACHE | |
| SCHEMBL14120856 | 0.76 | TBXAS1 (0.36) | ALDH1A1TSHR | |
| SCHEMBL6652592 | 0.73 | MAPT (0.33) | — | |
| SCHEMBL6654006 | 0.73 | TDP1 (0.36) | ALDH1A1 | |
| SCHEMBL148224 | 0.73 | PAOX (0.54) | PAOXCES2ALDH1A1DGKAACHE |
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-6534665-B1 | Used for polymerization and copolymerization of olefins | REPSOL QUIMICA S.A. (ES) | 2003-03-18 | — | — | US | claimed |
| EP-1095944-B1 | Single-carbon bridged bis cyclopentadienyl compounds and metallocene complexes thereof | REPSOL QUIMICA SA (ES) | 2004-03-17 | — | — | EP | disclosed |
| US-6534665-B1 | Used for polymerization and copolymerization of olefins | REPSOL QUIMICA S.A. (ES) | 2003-03-18 | — | — | US | disclosed |
| EP-1095944-A1 | Single-carbon bridged bis cyclopentadienyl compounds and metallocene complexes thereof | REPSOL QUIMICA S.A. (ES) | 2001-05-02 | — | — | EP | disclosed |