Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.58 |
| ▸ | BCR | P11274 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9469502 | 0.86 | ALDH1A1 (0.57) | GAAADORA2AADORA2BADORA1KDM4E | |
| SCHEMBL6951995 | 0.84 | ESR2 (0.59) | ABL1ABCB1BCRGAAPOLB | |
| SCHEMBL22001145 | 0.82 | ABL1 (0.46) | ABL1ABCB1BCRGAAPOLB | |
| SCHEMBL20282675 | 0.76 | POLB (0.54) | ABL1ABCB1BCRGAAPOLB | |
| SCHEMBL28133054 | 0.76 | ESR2 (0.53) | GAAESR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL29662936 | 0.76 | ESR2 (0.53) | GAAESR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL2533391 | 0.74 | AR (0.50) | ABL1ABCB1BCRGAAKDM4E | |
| SCHEMBL28802576 | 0.74 | MAOA (0.49) | GAAPOLBADORA2AADORA1ALDH1A1 | |
| SCHEMBL12672619 | 0.73 | AR (0.55) | ESR2KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15832019 | 0.73 | AR (0.44) | ABL1ABCB1BCRGAAKDM4E |
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-119451699-A | Medicine for combined use | 中外制药株式会社 | 2025-02-14 | — | — | CN | disclosed |