Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 3/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL13523276 | 0.86 | ALDH1A1 (0.44) | ALDH1A1PDE2AHRH4SLC6A2SLC6A3 | |
| SCHEMBL26699967 | 0.86 | ALDH1A1 (0.44) | ALDH1A1PDE2AHRH4SLC6A2SLC6A3 | |
| SCHEMBL27213513 | 0.80 | MAPT (0.46) | ALDH1A1MAPTSLC6A2SLC6A3NPC1 | |
| SCHEMBL816372 | 0.80 | MAPT (0.52) | ALDH1A1MAPTSLC6A2SLC6A3NPC1 | |
| SCHEMBL12868136 | 0.79 | ALDH1A1 (0.40) | ALDH1A1PDE2ASLC6A2SLC6A3SLC6A4 | |
| SCHEMBL15713182 | 0.79 | ALDH1A1 (0.42) | ALDH1A1PDE2ANPC1RAB9ANPBWR1 | |
| SCHEMBL16962007 | 0.79 | ALDH1A1 (0.41) | ALDH1A1PDE2AHRH4SLC6A2SLC6A3 | |
| SCHEMBL13144931 | 0.78 | ALDH1A1 (0.39) | ALDH1A1PDE2ASLC6A2SLC6A3SLC6A4 | |
| SCHEMBL16962005 | 0.78 | ALDH1A1 (0.39) | ALDH1A1PDE2ASLC6A2SLC6A3SLC6A4 | |
| SCHEMBL17125230 | 0.78 | FFAR4 (0.39) | ALDH1A1PDE2ASLC6A2SLC6A3SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4234548-A1 | SUBSTITUTED BENZO OR PYRIDOPYRIMIDINE AMINE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | Suzhou Zelgen Biopharmaceutical Co., Ltd. (CN) | 2023-08-30 | — | — | EP | disclosed |