Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | VIP | P01282 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.36 |
| ▸ | KCNA6 | P17658 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | KCNA4 | P22459 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28928850 | 0.87 | PKM (0.44) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL28929413 | 0.83 | GAA (0.45) | HRH3ALDH1A1LMNACYP3A4HIF1A | |
| SCHEMBL28962238 | 0.80 | PKM (0.47) | PKMHRH3CREBBPDAOROCK2 | |
| SCHEMBL28928851 | 0.79 | PKM (0.53) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL28928839 | 0.79 | DAO (0.44) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL28928826 | 0.77 | PKM (0.40) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL28928861 | 0.76 | PKM (0.50) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL28928834 | 0.76 | PKM (0.50) | PKMHRH3CREBBPDAOVIP | |
| SCHEMBL28929186 | 0.76 | PKM (0.47) | PKMHRH3ADRA2AADRA1DCREBBP | |
| SCHEMBL26118199 | 0.72 | CREBBP (0.55) | PKMHRH3ADRA2AADRA1DCREBBP |
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 |
|---|---|---|---|---|---|---|---|
| CN-115583942-A | 2-substituted 5-phenyl-oxazole derivative, preparation method thereof and application thereof as MNK (MNK) inhibitor | 中国海洋大学 | 2023-01-10 | — | — | CN | disclosed |