Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6823744 | 0.82 | KMT2A (0.48) | ALDH1A1SMN1; SMN2KMT2AGRM5LMNA | |
| SCHEMBL6826032 | 0.77 | P2RY12 (0.49) | GRM5POLBHSD11B1 | |
| SCHEMBL29577310 | 0.76 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL5795083 | 0.76 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL6708175 | 0.76 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL781659 | 0.76 | CYP1A2 (0.87) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL7873004 | 0.75 | GRM5 (0.56) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL13648884 | 0.75 | CXCR3 (0.55) | L3MBTL1HSD11B1 | |
| Hydrochloric Acid SCHEMBL27538332 | 0.74 | CYP1A2 (0.97) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL3976856 | 0.74 | CXCR3 (0.54) | L3MBTL1 |
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-2004074287-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-09-02 | — | — | WO | claimed |