Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20420765 | 0.83 | FPR1 (0.43) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL20428408 | 0.83 | FPR1 (0.43) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL20420809 | 0.83 | FPR1 (0.43) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL20420746 | 0.82 | FPR1 (0.42) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL20428404 | 0.82 | MEN1 (0.49) | CYP3A4ALDH1A1HPGDKDM4EMEN1 | |
| SCHEMBL20428403 | 0.81 | TP53 (0.42) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL20420749 | 0.80 | L3MBTL1 (0.47) | CYP3A4ALDH1A1HPGDKDM4EMEN1 | |
| SCHEMBL20420755 | 0.80 | KMT2A (0.41) | CYP3A4PTGS2ALDH1A1HPGDKDM4E | |
| SCHEMBL14802519 | 0.80 | PTGS2 (0.51) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 | |
| SCHEMBL28231580 | 0.79 | PTGS2 (0.37) | CYP3A4CYP1A2CYP2C9CYP2C19PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108349959-B | 4-substituted coumarin derivative and preparation method and application thereof | 成都赜灵生物医药科技有限公司 | 2021-11-16 | — | — | CN | disclosed |
| CN-108349959-A | The coumarin derivative and its preparation method and application of 4 substitutions | 贵州百灵企业集团制药股份有限公司 | 2018-07-31 | — | — | CN | disclosed |