Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | ADH1A | P07327 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28655068 | 1.00 | CYP2D6 (0.31) | CYP2D6MAPTSMN1; SMN2ADH1AALDH1A1 | |
| SCHEMBL3376121 | 0.97 | SMN1; SMN2 (0.31) | MAPTSMN1; SMN2ALDH1A1RAB9AHRH3 | |
| SCHEMBL3377431 | 0.88 | MAPT (0.31) | MAPT | |
| SCHEMBL3373140 | 0.87 | — | — | |
| SCHEMBL3376546 | 0.86 | MAPT (0.33) | MAPTSMN1; SMN2 | |
| SCHEMBL3372778 | 0.82 | MAPT (0.32) | MAPTSMN1; SMN2 | |
| SCHEMBL5261086 | 0.78 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL5259120 | 0.78 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL3374354 | 0.77 | HTT (0.30) | SMN1; SMN2 | |
| SCHEMBL3370176 | 0.76 | — | — |
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-4452943-A | ADDING NITRILE-CONTAINING MATERIAL TO NON-POLAR THERMOPLASTIC POLYMER | GOLDMAN CONRAD | 1984-06-05 | — | — | US | disclosed |