Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27791140 | 0.98 | SMN1; SMN2 (0.54) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL27791127 | 0.98 | SMN1; SMN2 (0.54) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL27791362 | 0.95 | SMN1; SMN2 (0.56) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL29978535 | 0.91 | BCHE (0.52) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL29978379 | 0.90 | BCHE (0.55) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL29979248 | 0.88 | BCHE (0.51) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A | |
| SCHEMBL29978621 | 0.82 | BCHE (0.64) | KDM4EMAPK1HDAC6ALDH1A1HDAC3 | |
| SCHEMBL29978741 | 0.81 | BCHE (0.67) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL29978736 | 0.79 | BCHE (0.63) | KDM4ELMNAMAPK1HDAC6ALDH1A1 | |
| SCHEMBL7136308 | 0.77 | SMN1; SMN2 (0.55) | SMN1; SMN2KDM4ELMNAMAPK1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115286583-B | Diphenylamino pyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2024-01-30 | — | — | CN | claimed |
| CN-115286583-A | Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2022-11-04 | — | — | CN | claimed |
| CN-115286583-B | Diphenylamino pyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2024-01-30 | — | — | CN | disclosed |
| CN-115286583-A | Diphenylaminopyrimidine-containing compound, preparation and application thereof as HDACs enzyme inhibitor | 山东大学 | 2022-11-04 | — | — | CN | disclosed |