Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30661775 | 0.86 | EPHX1 (0.41) | ALDH1A1 | |
| SCHEMBL20143519 | 0.85 | OPRM1 (0.36) | ALDH1A1MAPTDRD3 | |
| SCHEMBL15775212 | 0.79 | BRD4 (0.36) | ALDH1A1MAPT | |
| SCHEMBL12528307 | 0.75 | — | — | |
| SCHEMBL13229790 | 0.74 | OPRM1 (0.35) | ALDH1A1MAPT | |
| SCHEMBL19598020 | 0.71 | TACR1 (0.45) | — | |
| SCHEMBL6482213 | 0.70 | CPB2 (0.36) | ALDH1A1MAPTDRD3 | |
| SCHEMBL27098380 | 0.70 | — | — | |
| SCHEMBL8164049 | 0.70 | — | — | |
| SCHEMBL16189945 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0783517-A2 | THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO. INC. (US) | 1997-07-16 | — | — | EP | disclosed |