Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 7/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.48 |
| ▸ | PPARG | P37231 | 7/20 | 0.47 |
| ▸ | PPARA | Q07869 | 4/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.44 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | MT-CO2 | P00403 | 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 | |
|---|---|---|---|---|
| SCHEMBL6426691 | 0.94 | PPARG (0.46) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL6424050 | 0.94 | PPARG (0.46) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL6427280 | 0.89 | PPARG (0.43) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL6423711 | 0.89 | PPARG (0.43) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL5809451 | 0.89 | AKR1C3 (0.49) | AKR1C3AKR1C2PPARGPPARAABCB1 | |
| SCHEMBL6423929 | 0.89 | PPARG (0.42) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL5439104 | 0.88 | AKR1C3 (0.59) | AKR1C3AKR1C2PPARGABCB1LMNA | |
| SCHEMBL5811078 | 0.88 | PPARG (0.43) | AKR1C3AKR1C2PPARGPPARAPTGS2 | |
| SCHEMBL6423391 | 0.87 | PPARG (0.46) | AKR1C3AKR1C2PPARGPPARA | |
| SCHEMBL6423236 | 0.87 | PPARG (0.46) | AKR1C3AKR1C2PPARGPPARA |
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-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | disclosed |