Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | PDE6D | O43924 | 1/20 | 0.32 |
| ▸ | TGM2 | P21980 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7895046 | 0.85 | ALDH1A1 (0.44) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL2794004 | 0.77 | ALDH1A1 (0.40) | ALDH1A1CYP2C19THRBTSHRCES2 | |
| SCHEMBL7895041 | 0.72 | CYP1A2 (0.38) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL17476436 | 0.72 | CYP2C9 (0.43) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL961692 | 0.70 | CYP2C9 (0.47) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL8524280 | 0.69 | HCAR2 (0.47) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL3248705 | 0.69 | CYP3A4 (0.54) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL7672216 | 0.69 | AKR1C3 (0.42) | ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2 | |
| SCHEMBL18546114 | 0.68 | CYP3A4 (0.53) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB | |
| SCHEMBL28464666 | 0.68 | CYP2C9 (0.53) | ALDH1A1CYP2C9CYP2C19CYP3A4THRB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6184323-B1 | FOR OPHTHALMIC LENSES | ESSILOR INTERNATIONAL-COMPAGNIE GENERALE D'OPTIQUE (FR) | 2001-02-06 | — | — | US | disclosed |