Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | RARA | P10276 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8772560 | 0.89 | CYP26A1 (0.30) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL6237663 | 0.80 | TYMS (0.36) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL6292652 | 0.78 | MALT1 (0.38) | — | |
| SCHEMBL8836702 | 0.78 | RARB (0.60) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL8772680 | 0.74 | IDO1 (0.34) | CYP3A4RARBRARG | |
| SCHEMBL8772589 | 0.73 | RARB (0.46) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL8772676 | 0.72 | RARG (0.39) | RARARARBRARG | |
| SCHEMBL8772590 | 0.71 | RARA (0.32) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL5736412 | 0.71 | PGR (0.38) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL2223568 | 0.70 | RARB (0.53) | CYP26A1CYP3A4RARARARBRARG |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0800517-A1 | ACETYLENES DISUBSTITUTED WITH A 5 OR 8 SUBSTITUTED TETRAHYDRONAPHTHYL OR DIHYDRONAPHTHYL GROUP AND WITH AN ARYL OR HETEROARYL GROUPS HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | Allergan (US) | 1997-10-15 | — | — | EP | disclosed |
| US-5591858-A | Acetylenes disubstituted with a 5 substituted tetrahydronaphthyl group and with an aryl or heteroaryl group having retinoid-like biological activity | ALLERGAN | 1997-01-07 | — | — | US | disclosed |
| WO-1996020930-A1 | ACETYLENES DISUBSTITUTED WITH A 5 OR 8 SUBSTITUTED TETRAHYDRONAPHTHYL OR DIHYDRONAPHTHYL GROUP AND WITH AN ARYL OR HETEROARYL GROUPS HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1996-07-11 | — | — | WO | disclosed |
| US-5514825-A | SYNTHETIC RETINOIDS | ALLERGAN, INC. (US) | 1996-05-07 | — | — | US | disclosed |