Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 6/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PDE1A | P54750 | 1/20 | 0.34 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | CD38 | P28907 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23177187 | 1.00 | AAK1 (0.41) | AAK1BACE1BACE2KDM1AMAOA | |
| SCHEMBL28536662 | 1.00 | AAK1 (0.41) | AAK1BACE1BACE2KDM1AMAOA | |
| SCHEMBL23177336 | 1.00 | AAK1 (0.41) | AAK1BACE1BACE2KDM1AMAOA | |
| SCHEMBL29791971 | 0.91 | AAK1 (0.44) | AAK1KDM1AMAOAMAOBKDM4E | |
| SCHEMBL2687892 | 0.91 | AAK1 (0.44) | AAK1KDM1AMAOAMAOBKDM4E | |
| SCHEMBL28627251 | 0.87 | AAK1 (0.41) | AAK1KDM4EGAAMAPTALOX15 | |
| SCHEMBL29502212 | 0.82 | AAK1 (0.48) | AAK1KDM4EGAAMAPTALOX15 | |
| SCHEMBL459719 | 0.82 | AAK1 (0.48) | AAK1KDM4EGAAMAPTALOX15 | |
| SCHEMBL27007895 | 0.80 | AAK1 (0.43) | AAK1KDM1AMAOAMAOBMAPT | |
| SCHEMBL12820435 | 0.79 | HSP90AA1 (0.48) | AAK1BACE1BACE2HSP90AA1HSP90AB1 |
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-112574189-B | EP300/CBP inhibitor | 海创药业股份有限公司 | 2024-05-31 | — | — | CN | disclosed |