Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | STS | P08842 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8558744 | 0.75 | LMNA (0.44) | ALDH1A1AOC3SMN1; SMN2LMNATSHR | |
| SCHEMBL14495941 | 0.72 | ALDH1A1 (0.38) | ALDH1A1KMT2AMEN1SMN1; SMN2TSHR | |
| Acetonitrile SCHEMBL8561616 | 0.72 | LMNA (0.42) | ALDH1A1AOC3SMN1; SMN2LMNATSHR | |
| SCHEMBL6801469 | 0.72 | AOC3 (0.41) | ALDH1A1KMT2AMEN1AOC3SMN1; SMN2 | |
| SCHEMBL7166616 | 0.72 | CNR2 (0.53) | ALDH1A1CNR1CNR2 | |
| SCHEMBL10952033 | 0.71 | PBRM1 (0.40) | ALDH1A1KMT2ASMN1; SMN2LMNAKIF11 | |
| SCHEMBL2950137 | 0.70 | ALDH1A1 (0.57) | ALDH1A1AOC3SMN1; SMN2LMNAHRH3 | |
| SCHEMBL15355750 | 0.70 | CNR2 (0.46) | ALDH1A1KMT2ACNR1CNR2MEN1 | |
| SCHEMBL1538350 | 0.70 | CNR2 (0.46) | ALDH1A1KMT2ACNR1CNR2MEN1 | |
| SCHEMBL20313083 | 0.70 | CNR2 (0.46) | ALDH1A1KMT2ACNR1CNR2MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0299379-B1 | PENTADIENAMIDE PAF-ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-21 | — | — | EP | disclosed |
| US-4975438-A | ANTICOAGULANT | HOFFMANN-LA ROCHE INC. (US) | 1990-12-04 | — | — | US | disclosed |
| EP-0299379-A1 | Pentadienamide PAF-antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1989-01-18 | — | — | EP | disclosed |
| US-4788206-A | CARDIOVASCULAR DISORDERS, PLATELETS | HOFFMANN-LA ROCHE INC. (US) | 1988-11-29 | — | — | US | disclosed |