Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL4621028 | 0.79 | RAB9A (0.34) | — | |
| SCHEMBL4620211 | 0.78 | POLB (0.33) | — | |
| SCHEMBL1362594 | 0.69 | TSHR (0.37) | TSHRCYP2C19ATM | |
| SCHEMBL4621326 | 0.69 | TSHR (0.33) | TSHRCYP2C19 | |
| SCHEMBL4620796 | 0.68 | ADAMTS5 (0.35) | — | |
| SCHEMBL4619866 | 0.63 | TSHR (0.33) | TSHRCYP2C19 | |
| SCHEMBL4620986 | 0.62 | TYMP (0.37) | TSHRCYP2C19ATM | |
| SCHEMBL1362082 | 0.61 | TSHR (0.36) | TSHRCYP2C19ATM | |
| SCHEMBL4618919 | 0.61 | TSHR (0.44) | TSHRCYP2C19ATM | |
| SCHEMBL3126654 | 0.60 | POLB (0.52) | TSHRCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1883454-A2 | AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND | Showa Denko K.K. (JP) | 2008-02-06 | — | — | EP | disclosed |
| WO-2006126729-A2 | AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND | SHOWA DENKO K.K. (JP) | 2006-11-30 | — | — | WO | disclosed |