Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 14/20 | 0.40 |
| ▸ | RARG | P13631 | 13/20 | 0.40 |
| ▸ | RARA | P10276 | 10/20 | 0.40 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 3/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9334964 | 0.84 | GABRP (0.37) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9007036 | 0.82 | RARB (0.60) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9850176 | 0.79 | RXRA (0.43) | RARBRARGRARACYP26A1RXRA | |
| SCHEMBL8759603 | 0.78 | RXRA (0.40) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9488403 | 0.77 | RARB (0.43) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9006975 | 0.76 | RARB (0.47) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL5737372 | 0.76 | AKR1B1 (0.42) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL8758787 | 0.75 | RARB (0.46) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9006999 | 0.73 | RARB (0.49) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL8772593 | 0.73 | RARB (0.45) | RARBRARGRARACYP26A1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0571546-B1 | CHROMAN AND THIOCHROMANS WITH PHENYLETHYNYL SUBSTITUENTS AT THE 7-POSITION HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN INC (US) | 1996-10-16 | — | — | EP | disclosed |
| US-5346915-A | Chromans and thiochromans with phenylethynyl substituents at the 7-position having retinold-like biological activity | ALLERGAN, INC. (US) | 1994-09-13 | — | — | US | disclosed |
| WO-1992014725-A1 | CHROMAN AND THIOCHROMANS WITH PHENYLETHYNYL SUBSTITUENTS AT THE 7-POSITION HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN, INC. (US) | 1992-09-03 | — | — | WO | disclosed |