Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL28208671 | 0.94 | TSHR (0.41) | TSHRLMNACYP1A2THRB | |
| SCHEMBL27290586 | 0.84 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL6135809 | 0.84 | CYP1A2 (0.31) | CYP1A2 | |
| Pentane SCHEMBL28114254 | 0.83 | — | — | |
| SCHEMBL27318307 | 0.80 | LMNA (0.30) | TSHRLMNA | |
| SCHEMBL1203395 | 0.80 | TSHR (0.36) | TSHRTHRB | |
| Hydroxyl Radical SCHEMBL28840866 | 0.79 | — | — | |
| Cyclohexane SCHEMBL103613 | 0.79 | TSHR (0.70) | TSHRLMNACYP1A2THRB | |
| Cyclopentane SCHEMBL3344833 | 0.79 | TSHR (0.70) | TSHRLMNACYP1A2THRB | |
| Cyclooctane SCHEMBL5446228 | 0.79 | TSHR (0.70) | TSHRLMNACYP1A2THRB |
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-114787282-A | Cationic emulsion composition of polyorganosiloxane and preparation method thereof | 信越化学工业株式会社 | 2022-07-22 | — | — | CN | disclosed |
| EP-1235877-B1 | THERMOPLASTIC SILICONE ELASTOMERS BASED ON FLUOROCARBON RESIN | DOW CORNING (US) | 2005-03-23 | — | — | EP | disclosed |