Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.33 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28922878 | 0.85 | PDCD1 (0.36) | LMNATSHRSMN1; SMN2CYP2C19L3MBTL1 | |
| SCHEMBL28922901 | 0.81 | PIK3CA (0.33) | LMNAAKR1B1CYP26A1CYP26B1 | |
| SCHEMBL30148890 | 0.80 | CYP26A1 (0.48) | LMNATSHRSMN1; SMN2CYP2C19L3MBTL1 | |
| SCHEMBL12348759 | 0.78 | CYP26A1 (0.48) | AKR1B1MAP3K14CYP26A1CYP26B1 | |
| SCHEMBL30148887 | 0.76 | KDM4E (0.40) | AKR1B1MAPT | |
| SCHEMBL28922824 | 0.76 | KDM4E (0.40) | AKR1B1MAPT | |
| SCHEMBL28922776 | 0.73 | ALDH1A1 (0.44) | AKR1B1AKR1B10MAPTAKR1A1 | |
| SCHEMBL28605146 | 0.72 | ITGB2 (0.43) | LMNASMN1; SMN2MAP3K14 | |
| SCHEMBL28840697 | 0.72 | CYP26A1 (0.51) | LMNATSHRSMN1; SMN2CYP2C19AKR1B1 | |
| SCHEMBL3438831 | 0.71 | PRSS1 (0.51) | — |
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 |