Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16970612 | 0.81 | ALDH1A1 (0.37) | ALDH1A1MAPK1CYP2A6MAOB | |
| SCHEMBL10449127 | 0.80 | ACHE (0.32) | ALDH1A1 | |
| SCHEMBL6189586 | 0.79 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL4466473 | 0.76 | MAPK1 (0.33) | ALDH1A1MAPK1CYP2A6MAOB | |
| SCHEMBL3905765 | 0.76 | AHR (0.33) | ALDH1A1MAPK1CYP2A6MAOB | |
| SCHEMBL11069373 | 0.76 | KIF11 (0.39) | ALDH1A1CYP2A6MAOB | |
| SCHEMBL9099132 | 0.73 | METAP2 (0.38) | — | |
| SCHEMBL8169396 | 0.73 | NQO2 (0.44) | ALDH1A1 | |
| SCHEMBL4463655 | 0.72 | MAPT (0.32) | ALDH1A1MAPK1 | |
| SCHEMBL4468568 | 0.72 | MEN1 (0.40) | MAPK1MAOB |
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-4163022-A | ANTIPLAQUE AGENTS | COOPER LABORATORIES, INC. (US) | 1979-07-31 | — | — | US | disclosed |