Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.45 |
| ▸ | ITGAV | P06756 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24518101 | 0.89 | ALDH1A1 (0.46) | ALDH1A1ITGB3ITGAVLMNACYP1A2 | |
| SCHEMBL25401501 | 0.80 | POLB (0.48) | ALDH1A1ITGB3ITGAVLMNACYP1A2 | |
| SCHEMBL29846955 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ITGB3ITGAVLMNACYP1A2 | |
| SCHEMBL24517998 | 0.79 | CA1 (0.67) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24518324 | 0.78 | ALDH1A1 (0.38) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29846712 | 0.77 | PSMB5 (0.50) | — | |
| SCHEMBL24517780 | 0.77 | CA1 (0.64) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24517873 | 0.74 | CYP3A4 (0.57) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24517900 | 0.73 | LMNA (0.62) | ALDH1A1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL25395918 | 0.72 | MEN1 (0.43) | ALDH1A1ITGB3ITGAVLMNAMEN1 |
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 |