Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.49 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | F7 | P08709 | 3/20 | 0.44 |
| ▸ | F3 | P13726 | 3/20 | 0.44 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | PPARD | Q03181 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.44 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | FABP3 | P05413 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | FABP4 | P15090 | 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 | |
|---|---|---|---|---|
| SCHEMBL17685812 | 0.96 | ESR1 (0.52) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL21698664 | 0.96 | ESR1 (0.52) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL16154809 | 0.96 | ESR1 (0.52) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL16012923 | 0.89 | ESR1 (0.45) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL21300622 | 0.89 | ESR1 (0.45) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL16012922 | 0.89 | ESR1 (0.45) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL16012945 | 0.88 | ESR1 (0.43) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL16012946 | 0.88 | ESR1 (0.43) | ESR1AKR1C3AKR1C4AKR1C2AKR1C1 | |
| SCHEMBL17685721 | 0.85 | PLA2G2A (0.55) | ESR1AKR1C3ALDH1A1F7F3 | |
| SCHEMBL16154810 | 0.85 | PLA2G2A (0.55) | ESR1AKR1C3ALDH1A1F7F3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3608308-B1 | LIPIDS AND LIPID COMPOSITIONS FOR THE DELIVERY OF ACTIVE AGENTS | NOVARTIS AG (CH) | 2021-07-21 | — | — | EP | disclosed |