Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.43 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3714223 | 0.87 | ALDH1A1 (0.62) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL13188366 | 0.86 | CYP11B1 (0.67) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL3838348 | 0.84 | ALDH1A1 (0.61) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL3713649 | 0.84 | HDAC1 (0.52) | XDHFFAR1MKNK1MKNK2AAK1 | |
| SCHEMBL31704881 | 0.83 | ALDH1A1 (0.68) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL29771391 | 0.83 | ALDH1A1 (0.68) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL3714867 | 0.83 | ALDH1A1 (0.68) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL31705350 | 0.83 | ALDH1A1 (0.68) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 | |
| SCHEMBL3712340 | 0.82 | CYP11B2 (0.53) | ALDH1A1CYP11B1CYP11B2XDHMKNK1 | |
| SCHEMBL10028685 | 0.82 | ALDH1A1 (0.66) | ALDH1A1CYP11B1CYP11B2CYP19A1SLC2A1 |
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-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |