Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | PTGES | O14684 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10668856 | 0.93 | TP53 (0.52) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL10664842 | 0.90 | TP53 (0.54) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL10670780 | 0.87 | TP53 (0.58) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL10666333 | 0.85 | NPSR1 (0.57) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| Methoxymethane SCHEMBL10666178 | 0.82 | NPC1 (0.49) | TP53PTGESCYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL10664757 | 0.81 | NPSR1 (0.57) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL4142631 | 0.81 | CYP1A2 (0.73) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL10666339 | 0.78 | SMN1; SMN2 (0.54) | TP53LMNAPTGESCYP1A2SMN1; SMN2 | |
| SCHEMBL9857450 | 0.77 | GRM2 (0.45) | LMNAALDH1A1 | |
| Ether SCHEMBL10666173 | 0.77 | NPC1 (0.47) | TP53PTGESCYP1A2SMN1; SMN2ALDH1A1 |
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-4789680-A | Aralkyltriazole compounds | CIBA-GEIGY CORPORATION (US) | 1988-12-06 | — | — | US | disclosed |