Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL24920397 | 0.80 | CCR1 (0.35) | ALDH1A1CCR1CCR5CCR8KDM4E | |
| SCHEMBL24921166 | 0.79 | CCR1 (0.46) | PDE10AALDH1A1CCR1CCR5CCR8 | |
| SCHEMBL24921968 | 0.74 | PDE10A (0.37) | PDE10A | |
| SCHEMBL15935018 | 0.73 | MAPT (0.54) | ALDH1A1CCR1CCR5CCR8KDM4E | |
| SCHEMBL24921165 | 0.73 | ALOX5 (0.40) | PDE10AALDH1A1KDM4ERAB9ACYP1A2 | |
| SCHEMBL24921560 | 0.72 | EGLN1 (0.37) | PDE10AALDH1A1KDM4EGAADYRK1A | |
| SCHEMBL24920786 | 0.72 | HCRTR1 (0.37) | DYRK1ACYP1A2 | |
| SCHEMBL24921540 | 0.71 | PDE10A (0.36) | PDE10AALDH1A1CYP3A4CYP2C19USP2 | |
| SCHEMBL24920813 | 0.71 | PDK2 (0.37) | PDE10AALDH1A1CYP3A4CYP2C19USP2 | |
| SCHEMBL24142971 | 0.70 | PDE10A (0.41) | PDE10ABRD4BRD2BRD3CREBBP |
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-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |