Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 5/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 9/20 | 0.37 |
| ▸ | CNR1 | P21554 | 3/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25398268 | 1.00 | CTSA (0.42) | CTSAITGB1ITGA4CNR2CNR1 | |
| SCHEMBL25398263 | 1.00 | CTSA (0.42) | CTSAITGB1ITGA4CNR2CNR1 | |
| SCHEMBL25400011 | 0.90 | CTSA (0.43) | CTSAPSMB5P2RX7 | |
| SCHEMBL29846813 | 0.90 | CTSA (0.43) | CTSAPSMB5P2RX7 | |
| SCHEMBL25400016 | 0.90 | CTSA (0.43) | CTSAPSMB5P2RX7 | |
| SCHEMBL25401670 | 0.86 | PSMB5 (0.46) | CTSAPSMB5 | |
| SCHEMBL25401674 | 0.86 | PSMB5 (0.46) | CTSAPSMB5 | |
| SCHEMBL25395181 | 0.83 | PSMB5 (0.43) | CTSAPSMB5 | |
| SCHEMBL25395184 | 0.83 | PSMB5 (0.43) | CTSAPSMB5 | |
| SCHEMBL25398970 | 0.81 | CCR1 (0.47) | ITGB1ITGA4CCR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022123530-A1 | BORONIC ACID COMPOUND | 주식회사 엘지화학 | 2022-06-16 | — | — | WO | disclosed |