Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.40 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30635213 | 1.00 | BRD4 (0.54) | BRD4CYP2C19CYP3A4CYP11B2CYP11B1 | |
| SCHEMBL29135855 | 0.78 | BRD4 (0.50) | BRD4CYP11B2CYP11B1ALDH1A1PRMT5 | |
| SCHEMBL30635205 | 0.78 | BRD4 (0.50) | BRD4CYP11B2CYP11B1ALDH1A1PRMT5 | |
| SCHEMBL26953477 | 0.77 | BRD4 (0.45) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL29135873 | 0.74 | BRD4 (0.47) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL30635247 | 0.74 | BRD4 (0.47) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL7039667 | 0.71 | POLB (0.49) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL17809691 | 0.70 | CYP2C19 (0.49) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL315224 | 0.70 | BRD4 (0.41) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 | |
| SCHEMBL21051463 | 0.69 | PRMT5 (0.45) | BRD4CYP2C19CYP3A4ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117050074-A | Pyridine bisimidazopyridine compound and preparation method and application thereof | 中国药科大学 | 2023-11-14 | — | — | CN | disclosed |