Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.62 |
| ▸ | MAOB | P27338 | 1/20 | 0.62 |
| ▸ | POLL | Q9UGP5 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 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 | |
|---|---|---|---|---|
| SCHEMBL30487613 | 0.77 | MAOA (1.00) | MAOAMAOBKDM4EALDH1A1HPGD | |
| SCHEMBL3410798 | 0.76 | KDM4E (0.76) | POLLKDM4EALDH1A1HPGDGLA | |
| SCHEMBL6204130 | 0.74 | KDM4E (0.57) | POLLKDM4EALDH1A1HPGDGLA | |
| SCHEMBL30487601 | 0.72 | POLL (1.00) | MAOAMAOBPOLL | |
| SCHEMBL30487589 | 0.72 | POLL (0.54) | POLLKDM4EALDH1A1HPGDGLA | |
| SCHEMBL11495822 | 0.71 | KDM4E (0.47) | KDM4EALDH1A1HPGDGLAGAA | |
| SCHEMBL11495734 | 0.70 | MAPT (0.46) | KDM4EALDH1A1HPGDGLAGAA | |
| SCHEMBL28370465 | 0.70 | POLL (0.70) | MAOAMAOBPOLLKDM4EALDH1A1 | |
| SCHEMBL12553458 | 0.69 | KDM4E (0.57) | POLLKDM4EALDH1A1HPGDGLA | |
| SCHEMBL9506291 | 0.68 | POLL (0.49) | POLLKDM4EALDH1A1HPGDGLA |
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-110872268-B | Isocoumarin derivative and preparation method and medicinal application thereof | 复旦大学 | 2023-07-25 | — | — | CN | disclosed |