Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 6/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.55 |
| ▸ | FTO | Q9C0B1 | 3/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | AR | P10275 | 1/20 | 0.55 |
| ▸ | GABRP | O00591 | 4/20 | 0.53 |
| ▸ | GABRD | O14764 | 4/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.53 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12835504 | 0.87 | GABRP (0.47) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL4783697 | 0.83 | ALDH1A1 (0.67) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL8934583 | 0.79 | ACHE (0.54) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| Mitoflaxone SCHEMBL106705 | 0.78 | CYP1A2 (0.62) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL8934562 | 0.78 | MEN1 (0.67) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL12835503 | 0.76 | CYP1A2 (0.60) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL12835299 | 0.76 | CYP19A1 (0.55) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL12835306 | 0.76 | CYP19A1 (0.67) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL9550475 | 0.76 | MAOA (0.54) | ABCB1CYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL30738943 | 0.75 | ACHE (0.73) | ABCB1CYP1A1CYP1A2CYP1B1MEN1 |
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-2011023287-A1 | USE OF FAA AND ITS DERIVATIVES IN COSMETICS AND DERMATOLOGY | MERCK PATENT GMBH (DE) | 2011-03-03 | — | — | WO | disclosed |