Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 8/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24695067 | 0.87 | JAK3 (0.38) | JAK3SRCBTK | |
| SCHEMBL23323367 | 0.87 | JAK3 (0.38) | JAK3SRCBTK | |
| SCHEMBL25886730 | 0.77 | JAK3 (0.39) | JAK3BTK | |
| SCHEMBL15198071 | 0.76 | ATM (0.34) | — | |
| SCHEMBL24543360 | 0.73 | LMNA (0.35) | JAK3BTK | |
| SCHEMBL27324624 | 0.72 | MEN1 (0.31) | — | |
| SCHEMBL20935149 | 0.72 | OPRM1 (0.38) | IDH1 | |
| SCHEMBL18348016 | 0.72 | PIK3CD (0.41) | — | |
| SCHEMBL19909728 | 0.70 | JAK3 (0.35) | JAK3 | |
| SCHEMBL14885143 | 0.69 | LMNA (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021086833-A1 | SMALL MOLECULE INHIBITORS OF KRAS G12C MUTANT | MERCK SHARP & DOHME CORP. (US) | 2021-05-06 | — | — | WO | disclosed |