Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.57 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.57 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.57 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.57 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.57 |
| ▸ | TERT | O14746 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | TNKS | O95271 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12835503 | 0.91 | CYP1A2 (0.60) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| Mitoflaxone SCHEMBL106705 | 0.91 | CYP1A2 (0.62) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL12835505 | 0.89 | CYP1A2 (0.56) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL9327900 | 0.89 | CYP1A2 (0.56) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL12835324 | 0.89 | TNKS (0.59) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL12835627 | 0.89 | CYP2D6 (0.58) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL7085632 | 0.86 | CYP2D6 (0.53) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL7085634 | 0.86 | CYP2D6 (0.53) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL9526684 | 0.86 | CYP2D6 (0.56) | TDP1CYP1A2CSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL7087329 | 0.86 | CYP1A2 (0.56) | CYP1A2CYP1A1CYP1B1TERTCYP2D6 |
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 |