Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 12/20 | 0.41 |
| ▸ | RARG | P13631 | 12/20 | 0.41 |
| ▸ | RARA | P10276 | 9/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.41 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9176637 | 0.80 | RARB (0.64) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8558273 | 0.77 | RARA (0.56) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL9182226 | 0.75 | RARA (0.43) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8875276 | 0.74 | CYP3A4 (0.45) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8874983 | 0.73 | RARB (0.39) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8876387 | 0.73 | CYP3A4 (0.40) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8875222 | 0.72 | RARA (0.39) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8876089 | 0.72 | CYP3A4 (0.46) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL8864928 | 0.72 | RARA (0.41) | RARBRARGRARACYP3A4CYP26A1 | |
| SCHEMBL9743368 | 0.72 | FFAR1 (0.36) | RARBRARGRARACYP3A4CYP26A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5278318-A | Acetylation under Friedel Crafts condition | ALLERGAN, INC. (US) | 1994-01-11 | — | — | US | disclosed |
| WO-1992006084-A1 | CHROMANS AND THIOCHROMANS WITH RETINOID-LIKE ACTIVITY | ALLERGAN, INC. (US) | 1992-04-16 | — | — | WO | disclosed |