Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | GLO1 | Q04760 | 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 | |
|---|---|---|---|---|
| SCHEMBL9745192 | 1.00 | ALDH1A1 (0.37) | ALDH1A1TRPA1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL8988938 | 0.79 | TRPA1 (0.33) | ALDH1A1TRPA1HSD17B10 | |
| SCHEMBL8988929 | 0.79 | TRPA1 (0.33) | ALDH1A1TRPA1HSD17B10 | |
| SCHEMBL9745136 | 0.79 | CYP2D6 (0.33) | CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL8988983 | 0.79 | ALDH1A1 (0.33) | ALDH1A1TRPA1LMNAHSD17B10 | |
| SCHEMBL8989139 | 0.79 | ALDH1A1 (0.33) | ALDH1A1TRPA1LMNAHSD17B10 | |
| SCHEMBL8988976 | 0.79 | ALDH1A1 (0.33) | ALDH1A1TRPA1LMNAHSD17B10 | |
| SCHEMBL9744920 | 0.78 | CYP2D6 (0.43) | CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL8988782 | 0.78 | TRPA1 (0.33) | ALDH1A1TRPA1 | |
| SCHEMBL8988777 | 0.78 | TRPA1 (0.33) | ALDH1A1TRPA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5175344-A | Anticonvulsants, anxiolytic agents | CIBA-GEIGY CORPORATION (US) | 1992-12-29 | — | — | US | disclosed |
| US-5051413-A | For treatment of ischemia, antispasmodic agents, anticonvulsants and anxiety or manic conditions | CIBA-GEIGY CORPORATION (US) | 1991-09-24 | — | — | US | disclosed |