Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.30 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.30 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.30 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL30148869 | 0.81 | LMNA (0.33) | LMNAAKR1B1CYP26A1CYP26B1 | |
| SCHEMBL28922878 | 0.81 | PDCD1 (0.36) | PDCD1CD274LMNAAKR1B1CYP26A1 | |
| SCHEMBL30148890 | 0.77 | CYP26A1 (0.48) | LMNAAKR1B1CYP26A1CYP26B1 | |
| SCHEMBL28922824 | 0.73 | KDM4E (0.40) | AKR1B1 | |
| SCHEMBL30148887 | 0.73 | KDM4E (0.40) | AKR1B1 | |
| SCHEMBL1464785 | 0.72 | CD274 (0.50) | PIK3CAPIK3CGPDCD1CD274LMNA | |
| SCHEMBL28922776 | 0.70 | ALDH1A1 (0.44) | AKR1B1 | |
| SCHEMBL4133761 | 0.69 | CTNNB1 (0.43) | PDCD1CD274MAOAMAOB | |
| SCHEMBL4133763 | 0.69 | KCNH2 (0.46) | — | |
| SCHEMBL29790987 | 0.69 | KCNH2 (0.46) | — |
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-115521325-A | Boronic acid derivatives | 首药控股(北京)股份有限公司 | 2022-12-27 | — | — | CN | disclosed |