Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL299771 | 0.78 | AKR1C3 (0.57) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL299917 | 0.78 | AKR1C3 (0.57) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL13659051 | 0.76 | PTGS2 (0.56) | PTGS2 | |
| SCHEMBL668642 | 0.74 | ALDH1A1 (0.41) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL12486351 | 0.71 | PTGS2 (0.49) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL12486353 | 0.71 | PTGS2 (0.49) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL1486709 | 0.68 | MTNR1A (0.51) | AKR1C1 | |
| Benzaldehyde SCHEMBL28192263 | 0.67 | ALDH1A1 (0.58) | AKR1C3PTGS2AKR1C2AKR1C1 | |
| SCHEMBL28743306 | 0.66 | MAOB (0.72) | AKR1C3PTGS2 | |
| SCHEMBL30893663 | 0.66 | MAOB (0.72) | AKR1C3PTGS2 |
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-7432261-B2 | Anti-inflammatory phosphonate compounds | GILEAD SCIENCES, INC. (US) | 2008-10-07 | — | — | US | disclosed |