Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.34 |
| ▸ | CCR5 | P51681 | 3/20 | 0.34 |
| ▸ | CCR8 | P51685 | 3/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PDXK | O00764 | 1/20 | 0.32 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.30 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4944670 | 1.00 | CCR1 (0.34) | CCR1CCR5CCR8CYP2A6HDAC8 | |
| SCHEMBL26345976 | 0.82 | PDXK (0.34) | CCR1CCR5CCR8NOS3NOS2 | |
| SCHEMBL10426328 | 0.82 | PDXK (0.35) | CCR1CCR5CCR8CYP2A6HDAC8 | |
| SCHEMBL1567878 | 0.78 | NOS3 (0.30) | NOS3NOS2 | |
| SCHEMBL4796219 | 0.77 | CCR1 (0.54) | CCR1CCR5CCR8CYP2A6NOS3 | |
| SCHEMBL19443439 | 0.77 | CCR1 (0.39) | CCR1CCR5CCR8CYP2A6 | |
| SCHEMBL25141754 | 0.75 | PDE3B (0.34) | NOS3NOS2 | |
| SCHEMBL11830120 | 0.75 | NOS2 (0.40) | CYP2A6NOS3NOS2PDXK | |
| SCHEMBL19685357 | 0.75 | — | — | |
| SCHEMBL27453477 | 0.74 | CCR1 (0.32) | CCR1CCR5CCR8CYP2A6NOS3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114644738-B | Active nano emulsion and preparation method thereof | 清华大学 | 2023-07-14 | — | — | CN | disclosed |
| CN-114644738-A | Active nano latex and preparation method thereof | 清华大学 | 2022-06-21 | — | — | CN | disclosed |