Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 13/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 13/20 | 0.38 |
| ▸ | PDE9A | O76083 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 12/20 | 0.38 |
| ▸ | TSHR | P16473 | 10/20 | 0.38 |
| ▸ | USP2 | O75604 | 8/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23217009 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL25230775 | 0.90 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL24651144 | 0.90 | NPC1 (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL27217946 | 0.87 | EGFR (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL30813346 | 0.87 | EGFR (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL23217165 | 0.86 | EGFR (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL29844225 | 0.86 | EGFR (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL24651143 | 0.80 | CYP1A2 (0.46) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL25272291 | 0.79 | CYP1A2 (0.41) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE9A | |
| SCHEMBL25230106 | 0.78 | KMT2A (0.42) | ALDH1A1PDE9ATSHRMAPK1KMT2A |
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-4041401-A1 | HCK AS A THERAPEUTIC TARGET IN MYD88 MUTATED DISEASES | Dana-Farber Cancer Institute, Inc. (US) | 2022-08-17 | — | — | EP | disclosed |