Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 6/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 4/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.50 |
| ▸ | PDE5A | O76074 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13264829 | 0.82 | CYP1B1 (0.60) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL28637044 | 0.81 | CYP3A4 (0.56) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL7378576 | 0.81 | CYP1B1 (0.50) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL29307653 | 0.76 | CYP1A2 (0.63) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL1516397 | 0.73 | CYSLTR1 (0.78) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL8874138 | 0.73 | CYSLTR1 (0.59) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| Hydrochloric Acid SCHEMBL15668171 | 0.73 | CYP19A1 (0.49) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL8934600 | 0.73 | CYP19A1 (0.70) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| SCHEMBL4649417 | 0.73 | CYP1B1 (0.63) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 | |
| Hydrochloric Acid SCHEMBL15668160 | 0.73 | CYP19A1 (0.46) | CYP1A2CYP1B1CYP3A4CYP1A1CYP19A1 |
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-0080934-B1 | (4-OXO-4H-(1)-BENZOPYRAN-8-YL)-ALKANOIC ACIDS, SALTS AND DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1988-01-13 | — | — | EP | claimed |