Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 6/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.45 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6352157 | 0.91 | LMNA (0.45) | LMNAKCNMA1 | |
| SCHEMBL6349508 | 0.81 | AKR1C2 (0.49) | SERPINE1AKR1C2AKR1C1AKR1C3AKR1C4 | |
| SCHEMBL6357624 | 0.80 | CA12 (0.52) | SERPINE1AKR1C2AKR1C1AKR1C3AKR1C4 | |
| SCHEMBL6349527 | 0.76 | ALDH1A1 (0.61) | SERPINE1AKR1C2AKR1C1LMNA | |
| SCHEMBL6349448 | 0.72 | CA9 (0.67) | SERPINE1CA9CA12CA1CA2 | |
| SCHEMBL6352355 | 0.71 | CA9 (0.53) | SERPINE1AKR1C2AKR1C1AKR1C3AKR1C4 | |
| SCHEMBL4096497 | 0.69 | ALDH1A1 (0.61) | AKR1C2AKR1C1CA12CA7LMNA | |
| SCHEMBL6349618 | 0.68 | SERPINE1 (0.53) | SERPINE1AKR1C2AKR1C1AKR1C3AKR1C4 | |
| SCHEMBL13399604 | 0.68 | AKR1C2 (0.76) | AKR1C2AKR1C1AKR1C3AKR1C4LMNA | |
| SCHEMBL420142 | 0.67 | SERPINE1 (1.00) | SERPINE1AKR1C2AKR1C1AKR1C3AKR1C4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004018414-A2 | ANTIBACTERIAL AGENTS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-03-04 | — | — | WO | disclosed |