Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 5/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7353801 | 0.80 | AKR1C3 (0.43) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL7351298 | 0.80 | GAA (0.52) | — | |
| SCHEMBL7344761 | 0.80 | AKR1C3 (0.45) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL27146207 | 0.78 | AKR1C3 (0.54) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL11210301 | 0.76 | LMNA (0.48) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL28580616 | 0.76 | AKR1C3 (0.53) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL14941251 | 0.76 | ESR1 (0.49) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL4482850 | 0.75 | AKR1C3 (0.47) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL29882309 | 0.75 | PTGS2 (0.53) | AKR1C3PTGS2PTGS1 | |
| SCHEMBL7385357 | 0.74 | PTGS2 (0.42) | PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5663416-A | ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS OR DERMATITIS TREATMENT | CORTECH INC. | 1997-09-02 | — | — | US | disclosed |
| US-5214191-A | OXIDANT SENSITIVE AND INSENSITIVE AROMATIC ESTERS AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE | CORTECH, INC. (US) | 1993-05-25 | — | — | US | disclosed |
| EP-0465802-A1 | Oxidant sensitive and insensitive aromatic esters as inhibitors of human neutrophil elastase | CORTECH, INC. (US) | 1992-01-15 | — | — | EP | disclosed |