Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 5/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL2560536 | 0.85 | ALDH1A3 (0.40) | ALDH1A3ALDH3A1ALDH1A1HSP90AA1HSP90AB1 | |
| SCHEMBL29957280 | 0.80 | CYP2A6 (0.44) | ALDH1A3ALDH3A1ALDH1A1HSP90AA1HSP90AB1 | |
| SCHEMBL2564442 | 0.78 | HSP90AA1 (0.34) | ALDH1A3ALDH1A1HSP90AA1HSP90AB1CYP2C9 | |
| SCHEMBL29952071 | 0.76 | SLC6A4 (0.38) | ALDH1A3ALDH1A1HSP90AA1HSP90AB1CYP2C9 | |
| SCHEMBL2561890 | 0.73 | HSP90AA1 (0.36) | ALDH1A1HSP90AA1HSP90AB1CYP2C9CYP2C19 | |
| SCHEMBL31299760 | 0.70 | CYP2A6 (0.48) | ALDH1A3ALDH3A1ALDH1A1HSD17B10TDP1 | |
| SCHEMBL6814384 | 0.70 | CYP2A6 (0.48) | ALDH1A3ALDH3A1ALDH1A1HSD17B10TDP1 | |
| SCHEMBL2562764 | 0.70 | ALDH1A1 (0.40) | ALDH1A3ALDH3A1ALDH1A1TDP1CYP2A6 | |
| SCHEMBL29953414 | 0.69 | GAA (0.50) | ALDH1A1HSP90AA1HSP90AB1CYP2C9CYP2C19 | |
| SCHEMBL2555933 | 0.68 | ALDH1A1 (0.44) | ALDH1A3ALDH3A1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| US-11225655-B2 | Bi-functional complexes and methods for making and using such complexes | NUEVOLUTION A/S (DK) | 2022-01-18 | — | — | US | disclosed |
| EP-3540059-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | Nuevolution A/S (DK) | 2019-09-18 | — | — | EP | disclosed |
| EP-2558577-B1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION AS (DK) | 2018-12-12 | — | — | EP | disclosed |
| US-20130281324-A1 | BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2013-10-24 | — | — | US | disclosed |
| EP-2558577-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | Nuevolution A/S (DK) | 2013-02-20 | — | — | EP | disclosed |
| WO-2011127933-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2011-10-20 | — | — | WO | disclosed |