Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL22856408 | 0.87 | NAMPT (0.36) | CYP2D6CYP3A4CYP2C9ALDH1A1CYP1A2 | |
| SCHEMBL24764434 | 0.85 | ALDH1A1 (0.41) | CYP2D6CYP2C9ALDH1A1EPHX2EPHX1 | |
| SCHEMBL23945976 | 0.84 | NAMPT (0.36) | CYP2D6CYP3A4CYP2C9ALDH1A1EPHX2 | |
| SCHEMBL25728446 | 0.84 | ALDH1A1 (0.31) | CYP2D6CYP2C9ALDH1A1CYP1A2 | |
| SCHEMBL29325176 | 0.80 | PIK3CD (0.43) | CYP2D6CYP3A4CYP2C9ALDH1A1EPHX2 | |
| SCHEMBL104209 | 0.79 | EPHX2 (0.48) | EPHX2EPHX1PIK3CD | |
| SCHEMBL26246996 | 0.78 | HRH3 (0.32) | CYP2D6 | |
| SCHEMBL25157343 | 0.78 | EPHX2 (0.43) | CYP2D6CYP3A4CYP2C9ALDH1A1EPHX2 | |
| SCHEMBL24607223 | 0.77 | CYP2D6 (0.43) | CYP2D6CYP3A4CYP2C9ALDH1A1CYP1A2 | |
| SCHEMBL23992157 | 0.75 | CHRNB2 (0.39) | EPHX2EPHX1CYP1A2PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023192586-A1 | IRAK DEGRADERS AND USES THEREOF | KYMERA THERAPEUTICS, INC. (US) | 2023-10-05 | — | — | WO | disclosed |
| WO-2023081759-A1 | BIFUNCTIONAL PI3K-ALPHA INHIBITORS AND USES THEREOF | RELAY THERAPEUTICS, INC. (US) | 2023-05-11 | — | — | WO | disclosed |