Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.38 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29937256 | 1.00 | GAA (0.47) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL30998427 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL30998438 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL30998391 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL29344041 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL30998403 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL30998426 | 0.85 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL29937310 | 0.84 | GAA (0.44) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL29937083 | 0.84 | GAA (0.44) | GAAMEN1KMT2ATSHRTMEM97 | |
| SCHEMBL29937192 | 0.80 | GAA (0.40) | GAAMEN1KMT2ATSHRTMEM97 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4322954-A1 | SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT | Merck Sharp & Dohme LLC (US) | 2024-02-21 | — | — | EP | disclosed |
| WO-2022221739-A1 | SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT | MERCK SHARP & DOHME CORP. (US) | 2022-10-20 | — | — | WO | disclosed |