Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL10544574 | 1.00 | ALDH1A1 (0.37) | ALDH1A1NPC1RAB9ARXFP1KMT2A | |
| SCHEMBL10544809 | 0.88 | PKM (0.35) | ALDH1A1NPC1RAB9ARXFP1KMT2A | |
| SCHEMBL10544819 | 0.88 | PKM (0.35) | ALDH1A1NPC1RAB9ARXFP1KMT2A | |
| SCHEMBL10547616 | 0.84 | GAPDH (0.40) | ALDH1A1KMT2APKMHPGDKDM4E | |
| SCHEMBL10413424 | 0.84 | KDM5A (0.30) | — | |
| SCHEMBL10413422 | 0.84 | KDM5A (0.30) | — | |
| SCHEMBL10548246 | 0.83 | GAPDH (0.40) | ALDH1A1KMT2APKMHPGDKDM4E | |
| SCHEMBL10549582 | 0.82 | POLB (0.53) | ALDH1A1KMT2APKMMEN1MAPT | |
| SCHEMBL10548591 | 0.81 | ALDH1A1 (0.36) | ALDH1A1KMT2APKMMAPTKDM4E | |
| SCHEMBL10550552 | 0.81 | NPC1 (0.41) | ALDH1A1NPC1KMT2AMEN1SMN1; SMN2 |
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-4831130-A | β-lactam antibacterial agents | HOFFMANN-LA ROCHE INC. (US) | 1989-05-16 | — | — | US | disclosed |