Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31555979 | 0.90 | GAA (0.48) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11692308 | 0.89 | CA2 (0.45) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL20595268 | 0.87 | ALDH1A1 (0.47) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL20595296 | 0.87 | ALDH1A1 (0.47) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11806956 | 0.86 | MCHR1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19CA2 | |
| SCHEMBL10744933 | 0.85 | ALDH1A1 (0.46) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11599853 | 0.85 | GAA (0.46) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6686745 | 0.84 | SMN1; SMN2 (0.42) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7545806 | 0.83 | PSIP1 (0.47) | GAAALDH1A1CA2CA9CA1 | |
| SCHEMBL156710 | 0.81 | GAA (0.46) | GAAALDH1A1CYP3A4CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0991653-A1 | NOVEL COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 2000-04-12 | — | — | EP | disclosed |
| EP-0975636-A1 | NOVEL COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998054190-A1 | NOVEL COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-12-03 | — | — | WO | disclosed |
| WO-1998046606-A1 | NOVEL COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-10-22 | — | — | WO | disclosed |