Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7366275 | 0.92 | MEN1 (0.35) | MEN1KMT2AGAACYP2C9CYP2C19 | |
| SCHEMBL7362726 | 0.84 | CYP2C19 (0.35) | PIK3CDMEN1KMT2ACYP2C19 | |
| SCHEMBL18244908 | 0.83 | TSHR (0.38) | MEN1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL8347582 | 0.79 | ALDH1A1 (0.35) | CYP2C9CYP2C19 | |
| SCHEMBL8015726 | 0.79 | ALDH1A1 (0.35) | CYP2C9CYP2C19 | |
| SCHEMBL27365590 | 0.77 | PRMT3 (0.36) | — | |
| SCHEMBL7361074 | 0.77 | MEN1 (0.33) | MEN1KMT2AGAACYP2C9CYP2C19 | |
| SCHEMBL6142270 | 0.77 | ALDH1A1 (0.33) | CYP2C9CYP2C19 | |
| SCHEMBL9024746 | 0.76 | PIK3CD (0.37) | PIK3CDMEN1KMT2A | |
| SCHEMBL211599 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5348953-A | Elastase inhibitor | MERCK & CO., INC. (US) | 1994-09-20 | — | — | US | disclosed |
| WO-1994013636-A1 | NEW SUBSTITUTED AZETIDINONES AS ANTI-INFLAMMATORY AND ANTIDEGENERATIVE AGENTS | MERCK & CO., INC. (US) | 1994-06-23 | — | — | WO | disclosed |
| EP-0525973-A2 | Substituted azetidinones as anti-inflammatory and antidegenerative agents | MERCK & CO. INC. (US) | 1993-02-03 | — | — | EP | disclosed |
| WO-1993000332-A1 | SUBSTITUTED AZETIDINONES AS ANTI-INFLAMMATORY AND ANTIDEGENERATIVE AGENTS | MERCK & CO., INC. (US) | 1993-01-07 | — | — | WO | disclosed |