Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 19/20 | 0.44 |
| ▸ | RARB | P10826 | 18/20 | 0.44 |
| ▸ | RARG | P13631 | 18/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.38 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7637519 | 0.85 | RARA (0.50) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7633717 | 0.82 | RARA (0.46) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7637339 | 0.82 | RARA (0.47) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7636209 | 0.82 | RARA (0.46) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7636402 | 0.81 | RARA (0.43) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7639392 | 0.81 | RARA (0.47) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL8772612 | 0.81 | RARA (0.45) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7637426 | 0.81 | RARA (0.52) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL8772615 | 0.81 | RARA (0.45) | RARARARBRARGCYP3A4KMT2A | |
| SCHEMBL7636104 | 0.80 | RARA (0.63) | RARARARBRARGCYP3A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |