Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | PPM1B | O75688 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4381247 | 0.83 | ALDH1A1 (0.49) | ALDH1A1PKMACEMMESLC1A2 | |
| SCHEMBL8583037 | 0.83 | ALDH1A1 (0.49) | ALDH1A1PKMACEMMESLC1A2 | |
| SCHEMBL987319 | 0.83 | MAPK1 (0.52) | ALDH1A1PKMMAPK1KDM4EALOX15 | |
| SCHEMBL988202 | 0.83 | MAPK1 (0.52) | ALDH1A1PKMMAPK1KDM4EALOX15 | |
| SCHEMBL18037121 | 0.79 | ALDH1A1 (0.40) | ALDH1A1PKMACESLC1A2KMT2A | |
| SCHEMBL12100863 | 0.78 | ALDH1A1 (0.53) | ALDH1A1PKMACEMAPK1KDM4E | |
| SCHEMBL15789780 | 0.77 | ALDH1A1 (0.53) | ALDH1A1PKMMAPK1KDM4EALOX15 | |
| SCHEMBL1226562 | 0.75 | ALDH1A1 (0.54) | ALDH1A1PKMMAPK1KDM4ECYP2C19 | |
| SCHEMBL1679404 | 0.74 | ALDH1A1 (0.46) | ALDH1A1PKMMAPK1KDM4ECYP2C19 | |
| SCHEMBL1269476 | 0.74 | ALDH1A1 (0.53) | ALDH1A1PKMMAPK1KDM4ECYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2315747-B1 | METHODS AND COMPOSITIONS RELATING TO SYNTHETIC BETA-1,6 GLUCOSAMINE OLIGOSACCHARIDES | BRIGHAM & WOMENS HOSPITAL INC (US) | 2017-12-06 | — | — | EP | claimed |