Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAF1 | P04049 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25400308 | 0.88 | LMNA (0.41) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL25400303 | 0.88 | LMNA (0.41) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL29847201 | 0.82 | NPC1 (0.51) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL24518166 | 0.81 | RAB9A (0.46) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL24518155 | 0.79 | RAB9A (0.46) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL29846648 | 0.79 | RAB9A (0.46) | LMNAALDH1A1SMN1; SMN2RAB9ACYP3A4 | |
| SCHEMBL25400906 | 0.77 | PSMB5 (0.46) | CYP3A4 | |
| SCHEMBL25400915 | 0.77 | PSMB5 (0.46) | CYP3A4 | |
| SCHEMBL29846840 | 0.76 | PSMB5 (0.45) | — | |
| SCHEMBL29846645 | 0.75 | NSD2 (0.47) | CASP1CASP3CASP7CASP8 |
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 |