Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5607045 | 0.75 | CYP2C9 (0.33) | CYP2C9CYP2C19 | |
| SCHEMBL7896534 | 0.73 | CYP2C9 (0.33) | CYP2C9CYP2C19HTT | |
| SCHEMBL2794002 | 0.72 | TSHR (0.31) | — | |
| Acrylic Acid Methyl Ester SCHEMBL27973734 | 0.69 | TGM2 (0.38) | CYP2C9CYP2C19HTT | |
| SCHEMBL2884756 | 0.67 | P2RX7 (0.41) | CYP2C9CYP2C19HTT | |
| SCHEMBL10794143 | 0.66 | THRA (0.32) | CYP2C9CYP2C19 | |
| SCHEMBL11596917 | 0.66 | CYP2C9 (0.33) | CYP2C9CYP2C19HTT | |
| SCHEMBL1153651 | 0.65 | CYP2C19 (0.37) | CYP2C9CYP2C19HTT | |
| SCHEMBL10627198 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL5459734 | 0.64 | TYMS (0.44) | — |
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 |