Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 17/20 | 0.41 |
| ▸ | JAK2 | O60674 | 16/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL29936728 | 0.89 | KMT2A (0.43) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL29344022 | 0.88 | KMT2A (0.43) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL30998665 | 0.87 | KMT2A (0.42) | JAK1JAK2KMT2AL3MBTL1KDM1A | |
| SCHEMBL25324188 | 0.83 | JAK1 (0.40) | JAK1JAK2 | |
| SCHEMBL29937484 | 0.82 | KMT2A (0.42) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL29344020 | 0.82 | KMT2A (0.42) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL29344024 | 0.81 | KMT2A (0.41) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL31323322 | 0.81 | KMT2A (0.41) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL29937230 | 0.79 | KMT2A (0.40) | JAK1JAK2KMT2AL3MBTL1 | |
| SCHEMBL25566963 | 0.78 | KDM1A (0.47) | KDM1A |
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 |