Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30635205 | 1.00 | BRD4 (0.50) | BRD4CYP2A6CYP11B2COMTALDH1A1 | |
| SCHEMBL24732298 | 0.80 | BRD4 (0.50) | BRD4COMTALDH1A1PRMT5WDR77 | |
| SCHEMBL20004367 | 0.80 | BRD4 (0.50) | BRD4CYP11B2COMTALDH1A1USP30 | |
| SCHEMBL29135845 | 0.78 | BRD4 (0.54) | BRD4CYP2A6CYP11B2ALDH1A1PTK2 | |
| SCHEMBL30635213 | 0.78 | BRD4 (0.54) | BRD4CYP2A6CYP11B2ALDH1A1PTK2 | |
| SCHEMBL17778757 | 0.72 | CCNC (0.44) | BRD4CYP11B2 | |
| SCHEMBL30635193 | 0.71 | BRD4 (0.49) | BRD4CYP2A6CYP11B2ALDH1A1PTK2 | |
| SCHEMBL29135878 | 0.71 | BRD4 (0.49) | BRD4CYP2A6CYP11B2ALDH1A1PTK2 | |
| SCHEMBL29135844 | 0.71 | BRD4 (0.43) | BRD4COMTALDH1A1PRMT5WDR77 | |
| SCHEMBL17203161 | 0.71 | KMT2A (0.46) | BRD4COMTALDH1A1NMT1PAK4 |
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 |