Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | CYP26A1 | O43174 | 12/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.46 |
| ▸ | SNCA | P37840 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13573934 | 0.88 | CYP26A1 (0.62) | CYP3A4ALDH1A1HPGDHSD17B10CYP26A1 | |
| SCHEMBL13573939 | 0.88 | CYP26A1 (0.62) | CYP3A4ALDH1A1HPGDHSD17B10CYP26A1 | |
| SCHEMBL4286192 | 0.88 | CYP26A1 (0.62) | CYP3A4ALDH1A1HPGDHSD17B10CYP26A1 | |
| SCHEMBL16344079 | 0.80 | ALDH1A1 (0.68) | CYP3A4ALDH1A1HPGDHSD17B10CYP26A1 | |
| SCHEMBL17702817 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL12265956 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL8001841 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL12313665 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL8209874 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL8001842 | 0.76 | LMNA (0.56) | CYP3A4ALDH1A1HPGDHSD17B10GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009153566-A1 | CYP26 INHIBITORS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2009-12-23 | — | — | WO | disclosed |