Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.45 |
| ▸ | RARG | P13631 | 4/20 | 0.45 |
| ▸ | RARA | P10276 | 3/20 | 0.45 |
| ▸ | ESR1 | P03372 | 10/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.44 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | BCR | P11274 | 2/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8662092 | 0.85 | PBRM1 (0.53) | ESR1ESR2HSD17B1CYP3A4PBRM1 | |
| SCHEMBL31650524 | 0.85 | PBRM1 (0.53) | ESR1ESR2HSD17B1CYP3A4PBRM1 | |
| SCHEMBL6423981 | 0.83 | RARB (0.68) | RARBRARGRARA | |
| SCHEMBL6419013 | 0.79 | SIRT1 (0.41) | RARBRARGRARAESR1ESR2 | |
| SCHEMBL10834419 | 0.78 | RARA (0.64) | RARBRARGRARAESR1ESR2 | |
| SCHEMBL6294335 | 0.78 | RARA (0.48) | RARBRARGRARA | |
| Methane SCHEMBL10834484 | 0.77 | RARA (0.62) | RARBRARGRARAESR1ESR2 | |
| SCHEMBL1806400 | 0.76 | PBRM1 (0.49) | ESR1ESR2HSD17B1CYP3A4PBRM1 | |
| SCHEMBL8661522 | 0.75 | NSD2 (0.41) | RARBRARGRARAESR1ESR2 | |
| SCHEMBL445935 | 0.73 | MALT1 (0.41) | ESR1ESR2PBRM1 |
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-1997048672-A2 | SUBSTITUTED TETRAHYDRONAPHTHALENE AND DIHYDRONAPHTHALENE DERIVATIVES HAVING RETINOID AND/OR RETINOID ANTAGONIST-LIKE BIOLOGICAL ACTIVITY | ALLERGAN SALES, INC. (US) | 1997-12-24 | — | — | WO | disclosed |