Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28382661 | 0.85 | MGLL (0.40) | RENHDAC4OPRM1ALDH1A1GAA | |
| SCHEMBL20769618 | 0.85 | STS (0.39) | MGLL | |
| SCHEMBL30487791 | 0.85 | STS (0.39) | MGLL | |
| SCHEMBL20769561 | 0.85 | HDAC4 (0.38) | SLC6A4HDAC4OPRM1ALDH1A1SLC6A2 | |
| SCHEMBL30487795 | 0.85 | HDAC4 (0.38) | SLC6A4HDAC4OPRM1ALDH1A1SLC6A2 | |
| SCHEMBL28382209 | 0.71 | HPGD (0.39) | SLC6A4ALDH1A1SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL20769650 | 0.67 | MGLL (0.47) | MGLL | |
| SCHEMBL20769763 | 0.67 | STS (0.42) | MGLL | |
| SCHEMBL20769616 | 0.65 | ANO1 (0.41) | MGLL | |
| SCHEMBL28380523 | 0.65 | MGLL (0.39) | RENOPRM1ALDH1A1GAAMGLL |
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-111032034-B | Spiro compounds and methods of making and using the same | H.隆德贝克有限公司 | 2023-05-02 | — | — | CN | disclosed |