Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 18/20 | 0.60 |
| ▸ | RARG | P13631 | 18/20 | 0.60 |
| ▸ | RARA | P10276 | 15/20 | 0.60 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.60 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5737254 | 0.87 | RARB (0.67) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL8670048 | 0.85 | RARB (0.48) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9058349 | 0.84 | RARB (0.58) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL7637331 | 0.80 | RARB (0.67) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL8671142 | 0.78 | RARB (0.58) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL8851156 | 0.77 | RARB (0.57) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL5736145 | 0.76 | RARB (0.56) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL29353973 | 0.76 | RARB (1.00) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL3302926 | 0.76 | RARB (1.00) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9003132 | 0.75 | RARB (0.64) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |