Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9586468 | 1.00 | TRPA1 (0.46) | TRPA1SLC6A2SLC6A4SLC6A3GAA | |
| SCHEMBL9586459 | 1.00 | TRPA1 (0.46) | TRPA1SLC6A2SLC6A4SLC6A3GAA | |
| SCHEMBL6548210 | 0.87 | TRPA1 (0.58) | TRPA1KMT2AMEN1ALDH1A1CYP3A4 | |
| SCHEMBL6548208 | 0.87 | TRPA1 (0.58) | TRPA1KMT2AMEN1ALDH1A1CYP3A4 | |
| SCHEMBL6547527 | 0.81 | TRPA1 (0.47) | TRPA1KMT2AMEN1ALDH1A1CYP3A4 | |
| SCHEMBL6546277 | 0.77 | TRPA1 (0.51) | TRPA1KMT2AMEN1ALDH1A1CYP2D6 | |
| SCHEMBL12197984 | 0.74 | AAK1 (0.45) | CYP19A1CYP11B2KMT2AMEN1ROCK2 | |
| SCHEMBL7803264 | 0.73 | KDM1A (0.42) | TRPA1GAAMAPK1ALDH1A1HPGD | |
| SCHEMBL10591109 | 0.73 | KDM1A (0.42) | TRPA1GAAMAPK1ALDH1A1HPGD | |
| SCHEMBL3631547 | 0.73 | KDM1A (0.42) | TRPA1GAAMAPK1ALDH1A1HPGD |
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-5262420-A | Phenylalkylpyridines | IDEMITSU KOSAN CO., LTD. (JP) | 1993-11-16 | — | — | US | disclosed |
| EP-0383950-A1 | PYRIDINE DERIVATIVES AND INSECTICIDAL AND MITICIDAL AGENT CONTAINING SAME AS ACTIVE INGREDIENT | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1990-08-29 | — | — | EP | disclosed |