Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MPI | P34949 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29952455 | 0.87 | ALDH1A1 (0.36) | ALDH1A1KDM4EHPGDCCR1NOS2 | |
| SCHEMBL3089372 | 0.87 | ALDH1A1 (0.36) | ALDH1A1KDM4EHPGDCCR1NOS2 | |
| SCHEMBL29950842 | 0.84 | ALDH1A1 (0.37) | ALDH1A1KDM4EHPGDCCR1CYP1A2 | |
| SCHEMBL13730783 | 0.84 | KDM4E (0.34) | ALDH1A1KDM4EHPGDCCR1 | |
| SCHEMBL27846488 | 0.84 | ALDH1A1 (0.37) | ALDH1A1KDM4EHPGDCCR1CYP1A2 | |
| SCHEMBL29958148 | 0.84 | ERN1 (0.35) | ALDH1A1KDM4EHPGDCCR1ERN1 | |
| SCHEMBL10974012 | 0.78 | NOS2 (0.43) | ALDH1A1KDM4ECCR1NOS2CYP1A2 | |
| SCHEMBL302283 | 0.74 | CCR1 (0.40) | ALDH1A1CCR1 | |
| SCHEMBL23444797 | 0.74 | NOS2 (0.37) | ALDH1A1KDM4ECCR1NOS2CYP3A4 | |
| SCHEMBL13724354 | 0.74 | GRM4 (0.53) | NOS2CYP1A2CYP3A4CYP2D6CYP2C19 |
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 1 patent. 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 |