Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.49 |
| ▸ | MMP3 | P08254 | 2/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8442527 | 0.88 | ALDH1A1 (0.49) | ALDH1A1POLBKDM4EPKMSMN1; SMN2 | |
| SCHEMBL8437964 | 0.87 | L3MBTL1 (0.53) | ALDH1A1POLBCYP3A4TSHR | |
| SCHEMBL8442980 | 0.85 | MMP2 (0.47) | ALDH1A1POLBPKMSGMS1MMP3 | |
| SCHEMBL8441482 | 0.84 | ALDH1A1 (0.50) | ALDH1A1POLBSGMS1TSHRTP53 | |
| SCHEMBL8440592 | 0.84 | ALDH1A1 (0.59) | ALDH1A1POLBCYP2D6CYP2C19PKM | |
| SCHEMBL8437801 | 0.82 | ALDH1A1 (0.57) | ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL8438771 | 0.81 | KMT2A (0.53) | ALDH1A1POLBPKMMMP3 | |
| SCHEMBL8440913 | 0.78 | TBXAS1 (0.51) | — | |
| SCHEMBL8443157 | 0.77 | MEP1B (0.49) | ALDH1A1POLBAKR1C3 | |
| SCHEMBL8441009 | 0.76 | CA1 (0.41) | ALDH1A1POLB |
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-5955505-A | TREATING NERVE DEGENERATIVE DISORDERS | NIPPON SUISAN KAISHA, LTD. (JP) | 1999-09-21 | — | — | US | disclosed |