Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| 3-Methylbutanol SCHEMBL11793232 | 0.85 | ALDH1A1 (0.40) | TSHR | |
| Isobutanol SCHEMBL28235407 | 0.81 | TSHR (0.53) | TSHR | |
| Dioxane SCHEMBL5992691 | 0.79 | PIK3CD (0.37) | TSHR | |
| 3-Methylbutanol SCHEMBL12054 | 0.78 | — | — | |
| 3-Methylbutanol SCHEMBL901083 | 0.78 | TSHR (0.50) | TSHR | |
| 3-Methylbutanol SCHEMBL8407955 | 0.78 | TSHR (0.50) | TSHR | |
| 3-Methylbutanol SCHEMBL4806376 | 0.74 | — | — | |
| 3-Methylbutanol SCHEMBL4323028 | 0.74 | — | — | |
| 3-Methylbutanol SCHEMBL18229919 | 0.74 | — | — | |
| 3-Methylbutanol SCHEMBL8463763 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112673009-A | Substituted triazoloquinoxaline derivatives | 格吕伦塔尔有限公司 | 2021-04-16 | — | — | CN | disclosed |
| US-7144902-B1 | Prodrugs of thrombin inhibitors | ABBOTT GMBH & CO. KG (DE) | 2006-12-05 | — | — | US | disclosed |