Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | RARB | P10826 | 3/20 | 0.42 |
| ▸ | RARG | P13631 | 3/20 | 0.42 |
| ▸ | RARA | P10276 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7872249 | 1.00 | CYP3A4 (0.43) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7872185 | 0.84 | RARB (0.54) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7872176 | 0.84 | RARB (0.54) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7872240 | 0.83 | RARB (0.44) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7872237 | 0.83 | RARB (0.44) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7872262 | 0.82 | CYP3A4 (0.43) | CYP3A4RARBRARGRARAALDH1A1 | |
| SCHEMBL7872258 | 0.82 | CYP3A4 (0.43) | CYP3A4RARBRARGRARAALDH1A1 | |
| SCHEMBL27789177 | 0.75 | CYP3A4 (0.60) | CYP3A4MAPTALDH1A1TSHRHSD17B10 | |
| SCHEMBL7879873 | 0.73 | RARB (0.52) | CYP3A4MAPTRARBRARGRARA | |
| SCHEMBL7879878 | 0.73 | RARB (0.52) | CYP3A4MAPTRARBRARGRARA |
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-6326510-B1 | SKIN DISORDERS; ANTICANCER AGENTS | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) | 2001-12-04 | — | — | US | disclosed |