Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22876921 | 0.92 | RECQL (0.34) | ACHEALDH1A1LMNARECQL | |
| SCHEMBL17951396 | 0.83 | — | — | |
| SCHEMBL10416262 | 0.83 | — | — | |
| SCHEMBL19251580 | 0.83 | — | — | |
| SCHEMBL19850985 | 0.83 | — | — | |
| SCHEMBL16903319 | 0.75 | MGLL (0.35) | ACHEMGLLLMNARECQL | |
| SCHEMBL14818584 | 0.75 | ALDH1A1 (0.34) | ALDH1A1LMNA | |
| SCHEMBL292798 | 0.71 | — | — | |
| SCHEMBL11014798 | 0.71 | — | — | |
| SCHEMBL254419 | 0.71 | — | — |
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-2022250170-A9 | SMALL MOLECULE INHIBITORS OF KRAS MUTATED PROTEINS | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2023-01-05 | — | — | WO | disclosed |