Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | RARA | P10276 | 1/20 | 0.31 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | RARG | P13631 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845179 | 0.95 | CYP4F2 (0.36) | CYP4F2CYP4A11GSTP1CYP1A2CYP3A4 | |
| SCHEMBL9845166 | 0.94 | ALDH1A1 (0.32) | CYP4F2CYP4A11RARARARBRARG | |
| SCHEMBL9845177 | 0.89 | CYP4F2 (0.31) | CYP4F2CYP4A11RARARARBRARG | |
| SCHEMBL9845186 | 0.73 | KDM4E (0.31) | CYP4F2CYP4A11 | |
| SCHEMBL8864864 | 0.73 | HPGD (0.33) | CYP4F2CYP4A11RARARARBRARG | |
| SCHEMBL9845198 | 0.72 | ALDH1A1 (0.34) | CYP4F2CYP4A11 | |
| SCHEMBL8866010 | 0.72 | CYP4F2 (0.32) | CYP4F2CYP4A11RARARARBRARG | |
| SCHEMBL8865333 | 0.72 | RARA (0.35) | CYP4F2CYP4A11CYP3A4RARARARB | |
| SCHEMBL8865174 | 0.71 | CYP3A4 (0.36) | CYP4F2CYP4A11CYP3A4RARARARB | |
| SCHEMBL8865478 | 0.71 | CYP4F2 (0.34) | CYP4F2CYP4A11RARARARBRARG |
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-0419131-A2 | Acetylenes disubstituted with a phenyl group and a 2-substituted chromanyl, thiochromanyl or 1,2,3,4-tetrahydroquinolinyl group having retinoid-like activity | ALLERGAN, INC. (US) | 1991-03-27 | — | — | EP | disclosed |