Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 2/20 | 0.45 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.45 |
| ▸ | RARB | P10826 | 7/20 | 0.43 |
| ▸ | RARG | P13631 | 7/20 | 0.43 |
| ▸ | RARA | P10276 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 4/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 4/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.38 |
| ▸ | RXRA | P19793 | 2/20 | 0.38 |
| ▸ | SSTR5 | P35346 | 2/20 | 0.37 |
| ▸ | HNF4A | P41235 | 1/20 | 0.35 |
| ▸ | DRD5 | P21918 | 1/20 | 0.35 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665003 | 0.86 | RARB (0.44) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL2246604 | 0.84 | CYP26A1 (0.51) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9817786 | 0.83 | CYP26A1 (0.45) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL6037049 | 0.81 | RARB (0.67) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9484092 | 0.80 | RARB (0.62) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9817702 | 0.80 | RARB (0.39) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9817812 | 0.79 | RARB (0.48) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9817847 | 0.79 | CYP4F2 (0.43) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9139510 | 0.78 | RARB (0.47) | CYP26A1CYP26B1RARBRARGRARA | |
| SCHEMBL9817831 | 0.78 | RARB (0.40) | CYP26A1CYP26B1RARBRARGRARA |
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-0290130-B1 | ACETYLENES DISUBSTITUTED WITH A PHENYL GROUP AND A HETEROBICYCLIC GROUP HAVING RETINOID LIKE ACTIVITY | ALLERGAN, INC (US) | 1991-11-06 | — | — | EP | disclosed |
| US-4810804-A | PSORIASIS | ALLERGAN, INC. (US) | 1989-03-07 | — | — | US | disclosed |
| EP-0290130-A1 | Acetylenes disubstituted with a phenyl group and a heterobicyclic group having retinoid like activity | ALLERGAN, INC (US) | 1988-11-09 | — | — | EP | disclosed |