Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.39 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL29280614 | 0.84 | L3MBTL1 (0.41) | SMN1; SMN2GAAPOLBRAB9AMAPT | |
| SCHEMBL826276 | 0.79 | CHRM3 (0.49) | SMN1; SMN2GAAPOLBRAB9AKCNH2 | |
| SCHEMBL29280645 | 0.79 | MEN1 (0.46) | GAAPOLBRAB9ANPC1MAPT | |
| SCHEMBL29280625 | 0.78 | RAB9A (0.41) | SMN1; SMN2POLBRAB9ANPC1MAPT | |
| SCHEMBL25907218 | 0.75 | CHRM3 (0.42) | SMN1; SMN2GAAPOLBRAB9ANPC1 | |
| SCHEMBL28905886 | 0.73 | CHRM3 (0.54) | SMN1; SMN2GAAPOLBRAB9AMAPT | |
| SCHEMBL12475728 | 0.72 | KMT2A (0.48) | SMN1; SMN2GAAPOLBRAB9ANPC1 | |
| SCHEMBL21085191 | 0.70 | POLB (0.44) | SMN1; SMN2GAAPOLBRAB9AMAPT | |
| SCHEMBL29280605 | 0.69 | KMT2A (0.44) | SMN1; SMN2GAAPOLBRAB9ANPC1 | |
| SCHEMBL25907838 | 0.69 | CHRM3 (0.42) | SMN1; SMN2GAAPOLBRAB9AKCNH2 |
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-117777172-A | Benzo five-membered ring boric acid ester-3-carboxylic acid compound and application thereof | 四川大学 | 2024-03-29 | — | — | CN | disclosed |