Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.52 |
| ▸ | AXL | P30530 | 1/20 | 0.52 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.52 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.50 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15810800 | 0.96 | CYP2A6 (0.65) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL21117061 | 0.90 | CYP19A1 (0.59) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL22560719 | 0.88 | CYP2A6 (0.56) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL19781967 | 0.87 | CYP2A6 (0.54) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL20081056 | 0.86 | CYP2A6 (0.58) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL5077838 | 0.85 | CYP2A6 (0.62) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL12068478 | 0.84 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL12108682 | 0.84 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL12956908 | 0.84 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 | |
| SCHEMBL31508264 | 0.84 | CYP2A6 (0.83) | CYP2A6ALDH1A1CYP3A4CYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5128335-A | Antibiotics | MERCK & CO., INC. (US) | 1992-07-07 | — | — | US | disclosed |
| EP-0481662-A1 | 2-Heteroarylphenyl-carbapenem antibacterial agents | MERCK & CO. INC. (US) | 1992-04-22 | — | — | EP | disclosed |