Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TERT | O14746 | 1/20 | 0.69 |
| ▸ | MAOA | P21397 | 5/20 | 0.60 |
| ▸ | MAOB | P27338 | 5/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | XDH | P47989 | 1/20 | 0.60 |
| ▸ | BCL2 | P10415 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | IL2 | P60568 | 1/20 | 0.60 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL29089301 | 1.00 | TERT (0.69) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL950959 | 0.87 | MAPT (0.72) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL29089206 | 0.85 | TERT (0.72) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL30605372 | 0.85 | TERT (0.72) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL29089216 | 0.84 | TERT (0.68) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL17718192 | 0.84 | ALDH2 (0.74) | MAOAMAOBALDH2 | |
| SCHEMBL30527918 | 0.81 | ALDH2 (0.80) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL14070597 | 0.81 | ALDH2 (0.80) | TERTMAOAMAOBMAPTMEN1 | |
| SCHEMBL17718178 | 0.81 | ALDH2 (0.56) | MAOAMAOBMAPTMEN1ALDH1A1 | |
| SCHEMBL571576 | 0.80 | XDH (0.84) | TERTMAOAMAOBMAPTMEN1 |
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-116903571-A | Isoflavone compound or pharmaceutically acceptable ester or pharmaceutically salt thereof, preparation method and application thereof in preparing medicines for treating pain in vivo and medicines for reducing blood glucose | 郑州大学第一附属医院 | 2023-10-20 | — | — | CN | disclosed |