Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11035564 | 0.83 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTKCNN4CYP2C19 | |
| SCHEMBL8025041 | 0.74 | GAA (0.38) | CYP1A2CYP2D6MAPTHSP90AA1GPR55 | |
| SCHEMBL2364655 | 0.69 | CYP1A2 (0.42) | CYP1A2CYP2D6MAPTHSP90AA1GPR55 | |
| SCHEMBL27662931 | 0.68 | CYP1A2 (0.44) | CYP1A2CYP2D6MAPTHSP90AA1GPR55 | |
| SCHEMBL27159384 | 0.67 | CYP1A2 (0.44) | CYP1A2CYP2D6GAAKMT2A | |
| SCHEMBL27159381 | 0.67 | CYP1A2 (0.44) | CYP1A2CYP2D6GAAKMT2A | |
| SCHEMBL3249695 | 0.66 | CYP1A2 (0.50) | CYP1A2CYP2D6MAPTHSP90AA1GPR55 | |
| SCHEMBL935057 | 0.65 | SSTR4 (0.53) | CYP1A2MAPTKCNN4CYP2C19HIF1A | |
| SCHEMBL28905042 | 0.65 | HDAC3 (0.50) | CYP1A2CYP2D6MAPTKCNN4CYP2C19 | |
| SCHEMBL9159682 | 0.64 | KCNN4 (0.45) | CYP1A2CYP2D6MAPTKCNN4CYP2C19 |
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-6020518-A | Process for preparing β-amino-α-hydroxy acid derivatives | KANEKA CORPORATION (JP) | 2000-02-01 | — | — | US | disclosed |