Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 11/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | USP2 | O75604 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25707865 | 0.86 | CYP2D6 (0.49) | CYP2D6SMN1; SMN2HRH3CYP3A4CYP2C9 | |
| SCHEMBL8443212 | 0.83 | POLB (0.41) | CYP2D6SMN1; SMN2TSHRKMT2AALDH1A1 | |
| SCHEMBL15871711 | 0.79 | CYP2D6 (0.66) | CYP2D6SMN1; SMN2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL25708207 | 0.77 | CYP2D6 (0.46) | CYP2D6SMN1; SMN2HRH3CYP3A4CYP2C9 | |
| SCHEMBL20719249 | 0.76 | CYP2D6 (0.41) | CYP2D6SMN1; SMN2HRH3CYP3A4CYP2C9 | |
| SCHEMBL15893904 | 0.76 | POLB (0.37) | CYP2D6TSHRKMT2AALDH1A1MAPK1 | |
| SCHEMBL29326479 | 0.76 | HRH3 (0.39) | CYP2D6SMN1; SMN2HRH3CYP2C19EPHX2 | |
| SCHEMBL23559996 | 0.76 | TSHR (0.48) | CYP2D6SMN1; SMN2CYP2C9CYP2C19TSHR | |
| SCHEMBL25701697 | 0.74 | CYP2D6 (0.49) | CYP2D6SMN1; SMN2HRH3CYP3A4CYP2C9 | |
| SCHEMBL25706820 | 0.73 | CYP2D6 (0.46) | CYP2D6SMN1; SMN2CYP3A4CYP2C9CYP2C19 |
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-2023107606-A1 | BCL-XL/BCL-2 DUAL DEGRADERS FOR TREATMENT OF CANCERS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2023-06-15 | — | — | WO | disclosed |