Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | CD81 | P60033 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL523128 | 1.00 | ALDH1A1 (0.45) | ALDH1A1EP300TBXAS1CD81KDM4E | |
| SCHEMBL22972968 | 0.98 | ALDH1A1 (0.48) | ALDH1A1EP300TBXAS1CD81KDM4E | |
| SCHEMBL3428266 | 0.94 | ALDH1A1 (0.42) | ALDH1A1EP300TBXAS1CD81KDM4E | |
| SCHEMBL493110 | 0.94 | ALDH1A1 (0.42) | ALDH1A1EP300TBXAS1CD81KDM4E | |
| SCHEMBL8928149 | 0.88 | ALDH1A1 (0.39) | ALDH1A1EP300TBXAS1CD81KMT2A | |
| SCHEMBL8928144 | 0.88 | ALDH1A1 (0.39) | ALDH1A1EP300TBXAS1CD81KMT2A | |
| SCHEMBL15475483 | 0.87 | ALDH1A1 (0.37) | ALDH1A1EP300TBXAS1CD81TSHR | |
| SCHEMBL15475663 | 0.87 | ALDH1A1 (0.37) | ALDH1A1EP300TBXAS1CD81TSHR | |
| SCHEMBL137136 | 0.85 | CD81 (0.38) | ALDH1A1TBXAS1CD81BACE1PPARG | |
| SCHEMBL621263 | 0.85 | CD81 (0.38) | ALDH1A1TBXAS1CD81BACE1PPARG |
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-0346707-B1 | DENTAL MATERIALS | BAYER AG (DE) | 1993-02-17 | — | — | EP | disclosed |
| EP-0346708-B1 | FILLERS | BAYER AG (DE) | 1993-02-10 | — | — | EP | disclosed |