Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.58 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.55 |
| ▸ | EPAS1 | Q99814 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.55 |
| ▸ | RARA | P10276 | 6/20 | 0.51 |
| ▸ | RARB | P10826 | 5/20 | 0.51 |
| ▸ | RARG | P13631 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL8398195 | 0.87 | CYP3A4 (0.61) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 | |
| SCHEMBL7795292 | 0.83 | RARG (0.63) | CYP3A4HIF1AEPAS1MEN1KMT2A | |
| SCHEMBL8432432 | 0.79 | RARA (0.61) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 | |
| SCHEMBL8431940 | 0.78 | CYP3A4 (0.49) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 | |
| SCHEMBL8432429 | 0.77 | CYP3A4 (0.48) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 | |
| SCHEMBL8442941 | 0.76 | RARA (0.54) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 | |
| SCHEMBL8431769 | 0.75 | RARA (0.81) | CYP3A4MEN1KMT2ATHRBRECQL | |
| SCHEMBL8431773 | 0.75 | RARA (0.81) | CYP3A4MEN1KMT2ATHRBRECQL | |
| SCHEMBL9126833 | 0.74 | RARA (0.64) | CYP3A4HIF1AEPAS1MEN1KMT2A | |
| SCHEMBL3323551 | 0.74 | HSP90AA1 (0.56) | CYP3A4CYP26A1CYP26B1HIF1AEPAS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0776881-B1 | Bi-aromatic compounds comprising an adamantyl group in para-position, pharmaceutical and cosmetic compositions containing them and their utilization | CIRD GALDERMA (FR) | 1999-12-08 | — | — | EP | disclosed |
| EP-0776881-A1 | Bi-aromatic compounds comprising an adamantyl group in para-position, pharmaceutical and cosmetic compositions containing them and their utilization | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) | 1997-06-04 | — | — | EP | disclosed |