Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 3/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PPIA | P62937 | 1/20 | 0.33 |
| ▸ | RIOK2 | Q9BVS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8894257 | 0.91 | ALDH1A1 (0.37) | ALDH1A1POLBKCNK3LMNAMAPK1 | |
| SCHEMBL8890057 | 0.89 | NPC1 (0.37) | ALDH1A1POLBLMNAMAPK1SMN1; SMN2 | |
| SCHEMBL8890927 | 0.89 | ALDH1A1 (0.46) | ALDH1A1POLBKCNK3LMNAMAPK1 | |
| SCHEMBL8892248 | 0.89 | ALDH1A1 (0.35) | ALDH1A1POLBKCNK3LMNAMAPK1 | |
| SCHEMBL8891743 | 0.89 | LMNA (0.45) | ALDH1A1POLBLMNAMAPK1SMN1; SMN2 | |
| SCHEMBL8891578 | 0.88 | ALDH1A1 (0.39) | ALDH1A1POLBKCNK3LMNAMAPK1 | |
| SCHEMBL8890742 | 0.84 | LMNA (0.37) | ALDH1A1POLBLMNAMEN1KMT2A | |
| SCHEMBL8891769 | 0.82 | ABCC9 (0.33) | ALDH1A1POLBLMNASMN1; SMN2PTPRB | |
| SCHEMBL8893264 | 0.80 | NPC1 (0.38) | ALDH1A1POLBLMNAMAPK1SMN1; SMN2 | |
| SCHEMBL8890914 | 0.80 | CNR2 (0.39) | ALDH1A1POLBLMNAMAPK1SMN1; 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-5607976-A | ANNTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-03-04 | — | — | US | disclosed |