Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| 3-Methylbutanol SCHEMBL28181245 | 0.90 | — | — | |
| 3-Methylbutanol SCHEMBL901083 | 0.89 | TSHR (0.50) | TSHRALDH1A1CA1THRBALOX15 | |
| 3-Methylbutanol SCHEMBL12054 | 0.89 | — | — | |
| 3-Methylbutanol SCHEMBL8407955 | 0.89 | TSHR (0.50) | TSHRALDH1A1CA1THRBALOX15 | |
| 3-Methylbutanol SCHEMBL3485868 | 0.87 | TSHR (0.41) | TSHRALDH1A1CA1THRBALOX15 | |
| 3-Methylbutanol SCHEMBL6360717 | 0.87 | — | — | |
| 3-Methylbutanol SCHEMBL5500556 | 0.87 | TSHR (0.41) | TSHRALDH1A1CA1THRBALOX15 | |
| 3-Methylbutanol SCHEMBL29263419 | 0.87 | — | — | |
| 3-Methylbutanol SCHEMBL1317046 | 0.87 | — | — | |
| 3-Methylbutanol SCHEMBL5564948 | 0.87 | TSHR (0.41) | TSHRALDH1A1CA1THRBALOX15 |
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-7186782-B2 | Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2007-03-06 | — | — | US | disclosed |
| US-20060041079-A1 | Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer | TSRC CORPORATION | 2006-02-23 | — | — | US | disclosed |