Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25400405 | 1.00 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1CYP1A2CYP2C19POLB | |
| SCHEMBL25398251 | 0.88 | POLB (0.48) | ALDH1A1CYP1A2CYP2C19POLBCYP3A4 | |
| SCHEMBL29846640 | 0.88 | POLB (0.48) | ALDH1A1CYP1A2CYP2C19POLBCYP3A4 | |
| SCHEMBL29846753 | 0.87 | EGFR (0.45) | ALDH1A1L3MBTL1CYP1A2CYP2C19POLB | |
| SCHEMBL25401808 | 0.87 | EGFR (0.45) | ALDH1A1L3MBTL1CYP1A2CYP2C19POLB | |
| SCHEMBL25403157 | 0.87 | POLB (0.48) | POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29846542 | 0.86 | HPGD (0.40) | ALDH1A1CYP1A2CYP2C19HPGDCYP2D6 | |
| SCHEMBL25400448 | 0.86 | HPGD (0.40) | ALDH1A1CYP1A2CYP2C19HPGDCYP2D6 | |
| SCHEMBL25397863 | 0.85 | CHRM1 (0.41) | ALDH1A1L3MBTL1HPGDLMNANPC1 | |
| SCHEMBL25400794 | 0.85 | CYP1A2 (0.57) | ALDH1A1CYP1A2CYP2C19POLBHPGD |
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 |