Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 6/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 4/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24922026 | 0.87 | MAOA (0.36) | CYP2C19MAOAMAOBCDK2MAPK1 | |
| SCHEMBL24920379 | 0.83 | CDK2 (0.36) | CYP2C19CYP1A2MAP4K1ALDH1A1CCNA2 | |
| SCHEMBL24922037 | 0.83 | HRH4 (0.40) | KDM4EHPGDCCNA2CDK2MAPK1 | |
| SCHEMBL24922047 | 0.83 | CYP3A4 (0.34) | CYP2C19CYP1A2MAP4K1MAOAMAOB | |
| SCHEMBL24922030 | 0.83 | CHRNB2 (0.40) | CYP2C19MAOAMAOBMAPK1 | |
| SCHEMBL24922025 | 0.82 | MAPK1 (0.35) | CYP2C19MAOAMAOBKDM4EMEN1 | |
| SCHEMBL24920390 | 0.80 | CHIA (0.40) | PARP1KDM4ECCNA2CDK2MAPK1 | |
| SCHEMBL26626951 | 0.76 | CYP2C19 (0.47) | CYP2C19MAOAMAOBKDM4EMEN1 | |
| SCHEMBL12706720 | 0.75 | CYP2C19 (0.43) | CYP2C19CYP1A2CYP2C9KDM4EMEN1 | |
| SCHEMBL12969033 | 0.74 | MAOA (0.41) | CYP2C19CYP2C9MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |