Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25566962 | 0.84 | ACHE (0.39) | CYP2D6MEN1KMT2ACHRM3CHRM2 | |
| SCHEMBL25566735 | 0.83 | ACHE (0.38) | CHRM3CHRM2GAADRD2ACHE | |
| SCHEMBL25566734 | 0.78 | FUCA1 (0.42) | CHRM3CHRM2DRD2ALDH1A1 | |
| SCHEMBL25566966 | 0.77 | CYP2D6 (0.42) | CYP2D6CHRM3CHRM2GAAALDH1A1 | |
| SCHEMBL25566965 | 0.77 | CHRM3 (0.43) | MEN1KMT2ATSHRCHRM3CHRM2 | |
| SCHEMBL25566963 | 0.75 | KDM1A (0.47) | CHRM3CHRM2DRD2 | |
| SCHEMBL29937525 | 0.74 | CHRM3 (0.42) | CYP2D6MEN1KMT2ACHRM3CHRM2 | |
| SCHEMBL16197363 | 0.73 | CYP2D6 (0.52) | CYP2D6MEN1KMT2ACYP3A4TSHR | |
| SCHEMBL29937437 | 0.73 | CHRM3 (0.41) | CYP2D6MEN1KMT2ACHRM3CHRM2 | |
| SCHEMBL29936728 | 0.73 | KMT2A (0.43) | CYP2D6KMT2ACHRM3CHRM2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4442686-A1 | KRAS INHIBITORS, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF | Abbisko Therapeutics Co., Ltd (CN) | 2024-10-09 | — | — | EP | disclosed |