Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.49 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.48 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.44 |
| ▸ | CDK9 | P50750 | 2/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL31302450 | 0.90 | MKNK1 (0.43) | HRH4MKNK1MKNK2CCNT1CDK9 | |
| SCHEMBL12068738 | 0.87 | ADORA2A (0.45) | MKNK1MKNK2ASIC3ADORA2AADORA1 | |
| SCHEMBL4183278 | 0.83 | CHRNA7 (0.42) | HRH4HRH3ASIC3ADORA2AADORA1 | |
| SCHEMBL29851723 | 0.83 | CHRNA7 (0.46) | HRH4ASIC3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL18957072 | 0.83 | CHRNA7 (0.46) | HRH4ASIC3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL30073115 | 0.81 | KDM4E (0.44) | HRH4ASIC3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL18956812 | 0.81 | KDM4E (0.44) | HRH4ASIC3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL23612242 | 0.80 | CHEK1 (0.52) | ROCK1ROCK2MAP3K12 | |
| SCHEMBL29988658 | 0.80 | CHEK1 (0.52) | ROCK1ROCK2MAP3K12 | |
| SCHEMBL3388660 | 0.79 | ASIC3 (0.44) | MKNK1MKNK2ASIC3ADORA2AADORA1 |
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-2012158784-A2 | MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR | KAMENECKA THEODORE MARK (US) | 2012-11-22 | — | — | WO | disclosed |