Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31361277 | 0.82 | ALDH1A1 (0.38) | CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL25072439 | 0.77 | HSD11B1 (0.35) | ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL30718312 | 0.77 | HSD11B1 (0.35) | ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL6939703 | 0.71 | MAPT (0.47) | CYP1A2CYP2C9CYP2C19HTTKDM4E | |
| SCHEMBL31361300 | 0.70 | CACNA2D1 (0.48) | HTTMAPTMEN1KMT2APDE5A | |
| SCHEMBL12491359 | 0.66 | TRPM8 (0.34) | — | |
| SCHEMBL31082851 | 0.64 | CYP2A6 (0.33) | — | |
| SCHEMBL30592408 | 0.64 | F2RL1 (0.36) | — | |
| SCHEMBL6935588 | 0.63 | CYP1A2 (0.35) | CYP1A2CYP2D6CYP2C9CYP2C19HTT | |
| SCHEMBL12491276 | 0.62 | TRPM8 (0.33) | KDM4EALDH1A1POLB |
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-119161346-A | Pyrrolo-ring compound and application thereof in medicine | 康百达（四川）生物医药科技有限公司 | 2024-12-20 | — | — | CN | disclosed |