Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.76 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.46 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28318056 | 0.86 | MAOB (0.74) | MAOBCA2CA5AOPRD1ALDH1A1 | |
| SCHEMBL7328699 | 0.83 | MAOB (0.69) | MAOBCA2CA5AMEN1ALDH1A1 | |
| SCHEMBL28319037 | 0.81 | MAOB (0.59) | MAOBACHECA2CA5AMEN1 | |
| SCHEMBL28319039 | 0.80 | MAOB (0.60) | MAOBACHECA2CA5AOPRM1 | |
| SCHEMBL14192234 | 0.79 | MAOB (0.63) | MAOBCA2CA5AMAOA | |
| SCHEMBL16548460 | 0.76 | MAOB (0.56) | MAOBACHEMAOA | |
| SCHEMBL28319038 | 0.75 | MAOB (0.59) | MAOBCA2CA5AALDH1A1HPGD | |
| SCHEMBL28318057 | 0.75 | MAOB (0.61) | MAOBMAOA | |
| SCHEMBL31547905 | 0.74 | CA2 (0.54) | MAOBACHECA2CA5AMAPT | |
| SCHEMBL31547904 | 0.74 | CA2 (0.54) | MAOBACHECA2CA5AMAPT |
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-106588847-B | Dihydrocoumarin analog derivative and its preparation method and application | 上海中医药大学 | 2019-08-13 | — | — | CN | disclosed |