Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | USP7 | Q93009 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.33 |
| ▸ | BLK | P51451 | 1/20 | 0.33 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870508 | 0.82 | CHEK1 (0.42) | KDRAURKBUSP7FYNCSF1R | |
| SCHEMBL25297274 | 0.78 | GRM4 (0.44) | MKNK1MKNK2AURKAKDRAURKB | |
| SCHEMBL9846997 | 0.76 | NOS2 (0.38) | MKNK1MKNK2USP7ALDH1A1NOS3 | |
| Hydrochloric Acid SCHEMBL9847027 | 0.74 | NOS2 (0.37) | MKNK1MKNK2ALDH1A1NOS3NOS2 | |
| SCHEMBL305502 | 0.71 | NOS2 (0.45) | ALDH1A1NOS3NOS2DYRK1A | |
| SCHEMBL31150926 | 0.71 | NOS2 (0.45) | ALDH1A1NOS3NOS2DYRK1A | |
| SCHEMBL13368032 | 0.71 | MKNK1 (0.62) | MKNK1MKNK2AURKAKDRAURKB | |
| SCHEMBL24391059 | 0.70 | NOS2 (0.45) | AURKAKDRAURKBMAPTCYP2C9 | |
| SCHEMBL3679899 | 0.70 | KDM4E (0.47) | MAPTCYP3A4ALDH1A1TP53CYP19A1 | |
| SCHEMBL4527106 | 0.69 | COMT (0.36) | KDRUSP7MAPTCYP2C9CYP3A4 |
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-2001002357-A2 | PROCESS FOR THE SYNTHESIS OF 4-(4'-FLUOROPHENYL)-PIPERIDINES | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-01-11 | — | — | WO | disclosed |