Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | PRKACA | P17612 | 1/20 | 0.44 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.40 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3647738 | 0.77 | MAP2K3 (0.50) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL4053052 | 0.75 | MAP2K3 (0.56) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL5526316 | 0.72 | ASIC3 (0.50) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL28247990 | 0.72 | ASIC3 (0.50) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL27810693 | 0.68 | MAP2K3 (0.53) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL27807144 | 0.68 | ALDH1A1 (0.64) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL5329336 | 0.68 | ADORA1 (0.56) | ASIC3MEN1KMT2AADORA2AADORA1 | |
| SCHEMBL13329926 | 0.67 | AURKB (0.51) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL30675639 | 0.67 | AURKB (0.51) | ASIC3MEN1KMT2ARAB9AADORA2A | |
| SCHEMBL14917463 | 0.67 | MEN1 (0.62) | ASIC3MEN1KMT2ARAB9AADORA2A |
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-2009005638-A2 | PYRIDYL AND PYRIMIDINYL DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS | MERCK & CO., INC. (US) | 2009-01-08 | — | — | WO | disclosed |