Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10079673 | 0.82 | CXCR4 (0.51) | GAAPRMT6L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL4854395 | 0.82 | GAA (0.59) | CYP2D6GAACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL992110 | 0.78 | CYP2D6 (0.62) | CYP2D6CYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL8329828 | 0.78 | POLB (0.59) | CYP2D6ROCK2 | |
| Hydrochloric Acid SCHEMBL31687488 | 0.77 | CYP2D6 (0.60) | CYP2D6CYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL8328716 | 0.75 | CYP1A2 (0.49) | CYP2D6GAAL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL8325440 | 0.75 | MAOB (0.51) | CYP2D6GAAALDH1A1BCHEMAOB | |
| SCHEMBL10079263 | 0.75 | L3MBTL1 (0.47) | GAAPRMT6L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL17513615 | 0.74 | LTA4H (0.54) | CYP2D6GAAKAT2BALDH1A1KDM4E | |
| SCHEMBL4847846 | 0.73 | ALDH1A1 (0.56) | GAAL3MBTL1ALDH1A1KDM4EBCHE |
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-2012020220-A1 | COMPOUNDS | NOVACTA BIOSYSTEMS LIMITED (GB) | 2012-02-16 | — | — | WO | disclosed |