Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.58 |
| ▸ | PREP | P48147 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29846500 | 0.84 | NPC1 (0.47) | PREPCNR1CNR2ADORA2AADORA1 | |
| SCHEMBL29846645 | 0.82 | NSD2 (0.47) | NSD2PREPNR4A1ESR2DGAT2 | |
| SCHEMBL25401497 | 0.80 | NSD2 (0.46) | NSD2PREPNR4A1ESR2DGAT2 | |
| SCHEMBL25401502 | 0.80 | NSD2 (0.46) | NSD2PREPNR4A1ESR2DGAT2 | |
| SCHEMBL29846360 | 0.78 | NSD2 (0.62) | NSD2PREPNR4A1ESR2CNR1 | |
| SCHEMBL29846491 | 0.78 | KMT2A (0.48) | SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL29846547 | 0.77 | ADORA2A (0.41) | ADORA2AADORA1P2RX7ALDH1A1 | |
| SCHEMBL29846854 | 0.75 | UTS2R (0.36) | P2RX7ALDH1A1DRD4 | |
| SCHEMBL29846549 | 0.74 | NPC1 (0.51) | SMN1; SMN2 | |
| SCHEMBL16572948 | 0.72 | NSD2 (0.67) | NSD2PREPNR4A1ESR2P2RX7 |
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 |