Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MPL | P40238 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13841474 | 0.76 | NOS1 (0.42) | ALDH1A1NOS1 | |
| SCHEMBL26747517 | 0.74 | COMT (0.33) | ALDH1A1 | |
| SCHEMBL22121867 | 0.73 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL24015810 | 0.73 | ALDH1A1 (0.41) | ALDH1A1NOS1HPGDHSD17B10HSP90AA1 | |
| SCHEMBL5627523 | 0.73 | — | — | |
| SCHEMBL23942114 | 0.68 | — | — | |
| SCHEMBL8627226 | 0.67 | — | — | |
| SCHEMBL2616831 | 0.67 | — | — | |
| SCHEMBL23354329 | 0.67 | RBP4 (0.39) | ALDH1A1HPGD | |
| SCHEMBL23371356 | 0.66 | GAA (0.33) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023078813-A1 | HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS | MERCK PATENT GMBH (DE) | 2023-05-11 | — | — | WO | disclosed |
| WO-2021224291-A1 | TRICYCLIC HETEROCYCLES USEFUL AS TEAD BINDERS | MERCK PATENT GMBH (DE) | 2021-11-11 | — | — | WO | disclosed |