Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | TACR2 | P21452 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TOP2A | P11388 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL26740866 | 0.88 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAAKMT2ATOP2A | |
| SCHEMBL4703425 | 0.85 | ALDH1A1 (0.60) | ALDH1A1KDM4EKMT2AHPGDTDP1 | |
| SCHEMBL9314785 | 0.82 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDTDP1MAPT | |
| SCHEMBL11003783 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KDM4EGAATACR2KMT2A | |
| SCHEMBL31336541 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KDM4EGAATACR2TOP2A | |
| SCHEMBL1254905 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KDM4EGAATACR2TOP2A | |
| SCHEMBL15074321 | 0.80 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAHPGDTDP1 | |
| SCHEMBL29114949 | 0.79 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDTDP1MAPT | |
| SCHEMBL493684 | 0.79 | ALDH1A1 (0.73) | ALDH1A1KDM4EGAATACR2KMT2A | |
| SCHEMBL30159697 | 0.79 | ALDH1A1 (0.73) | ALDH1A1KDM4EGAATACR2KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0510817-B1 | Smoking compositions containing a vanillin-release additive | PHILIP MORRIS PROD (US) | 1995-06-14 | — | — | EP | claimed |
| US-5228461-A | Smoking compositions containing a vanillin-release additive | PHILIP MORRIS INCORPORATED (US) | 1993-07-20 | — | — | US | claimed |
| EP-0510817-A1 | Smoking compositions containing a vanillin-release additive | Philip Morris Products Inc. (US) | 1992-10-28 | — | — | EP | claimed |