Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 14/20 | 0.82 |
| ▸ | PFKFB4 | Q16877 | 8/20 | 0.79 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL21857521 | 0.90 | PFKFB3 (1.00) | PFKFB3PFKFB4LNPEP | |
| SCHEMBL21857339 | 0.89 | PFKFB3 (0.82) | PFKFB3PFKFB4LNPEP | |
| SCHEMBL21857159 | 0.89 | PFKFB3 (1.00) | PFKFB3PFKFB4LNPEP | |
| SCHEMBL21857057 | 0.89 | PFKFB4 (1.00) | PFKFB3PFKFB4 | |
| SCHEMBL21857478 | 0.88 | PFKFB3 (1.00) | PFKFB3PFKFB4LNPEP | |
| SCHEMBL21857359 | 0.87 | PFKFB3 (1.00) | PFKFB3PFKFB4 | |
| SCHEMBL21857007 | 0.87 | PFKFB3 (0.79) | PFKFB3PFKFB4 | |
| SCHEMBL30268334 | 0.87 | PFKFB3 (1.00) | PFKFB3PFKFB4 | |
| SCHEMBL21857667 | 0.84 | PFKFB3 (0.74) | PFKFB3PFKFB4LNPEP | |
| SCHEMBL794692 | 0.83 | PFKFB3 (0.57) | PFKFB3PFKFB4 |
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-113396145-A | PFKFB3 inhibitors and uses thereof | 盖罗发现有限责任公司 | 2021-09-14 | — | — | CN | disclosed |
| WO-2020080979-A1 | PFKFB3 INHIBITORS AND THEIR USES | GERO DISCOVERY LIMITED LIABILITY COMPANY (RU) | 2020-04-23 | — | — | WO | disclosed |