Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 19/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5738454 | 0.85 | RARB (0.52) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL6425787 | 0.83 | AKR1C3 (0.41) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL7980771 | 0.83 | RARB (0.38) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL7549795 | 0.82 | ACACB (0.32) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL5737179 | 0.82 | RARA (0.42) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL5737644 | 0.78 | — | — | |
| SCHEMBL7984179 | 0.74 | RARB (0.36) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL5735777 | 0.72 | RARA (0.43) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL5737683 | 0.71 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL16327448 | 0.71 | LMNA (0.61) | CYP3A4ACACB |
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 |
|---|---|---|---|---|---|---|---|
| US-6291677-B1 | FOR TREATING SKIN-RELATED DISEASES, INCLUDING, ACTINIC KERATOSES, ARSENIC KERATOSES, INFLAMMATORY AND NON-INFLAMMATORY ACNE, PSORIASIS, ICHTHYOSES AND KERATINIZATION AND HYPERPROLIFERATIVE DISORDERS OF SKIN | ALLERGAN SALES, INC. | 2001-09-18 | — | — | US | disclosed |