Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.53 |
| ▸ | MAPT | P10636 | 7/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.53 |
| ▸ | APP | P05067 | 4/20 | 0.53 |
| ▸ | SNCA | P37840 | 4/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | RBP4 | P02753 | 2/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.47 |
| ▸ | SLCO1B3 | Q9NPD5 | 2/20 | 0.47 |
| ▸ | SLCO1B1 | Q9Y6L6 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11779873 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL20659242 | 0.88 | ALDH1A1 (0.60) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL2837829 | 0.88 | ALDH1A1 (0.60) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL11648093 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL11783700 | 0.85 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL13979266 | 0.84 | ALDH1A1 (0.49) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL9267378 | 0.83 | ALOX15 (0.46) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL9267380 | 0.83 | ALOX15 (0.46) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL9182001 | 0.83 | ALDH1A1 (0.49) | ALDH1A1MAPTCYP3A4APPSNCA | |
| SCHEMBL9209859 | 0.83 | ALDH1A1 (0.49) | ALDH1A1MAPTCYP3A4APPSNCA |
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-3953524-A | Catalytic hydrogenation of alpha,beta-unsaturated aldehydes to alpha,beta-unsaturated alcohols | HOFFMANN-LA ROCHE INC. (US) | 1976-04-27 | — | — | US | disclosed |