Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.43 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16518060 | 0.90 | CYP1A2 (0.47) | CYP1A2PDE4BABHD6STSNR1H2 | |
| SCHEMBL5456815 | 0.90 | KDM4E (0.47) | CYP1A2PDE4BABHD6STSNR1H2 | |
| SCHEMBL5095884 | 0.83 | ESR2 (0.43) | ABHD6NR1H2HDAC1ALDH1A1ESR2 | |
| SCHEMBL19358137 | 0.83 | USP30 (0.42) | ABHD6NR1H2HDAC1ESR2MAPK1 | |
| SCHEMBL21436454 | 0.82 | NR1H2 (0.44) | ABHD6NR1H2HDAC1KDM4EALDH1A1 | |
| SCHEMBL25953613 | 0.81 | PDE4B (0.41) | PDE4BABHD6STSNR1H2PDE4A | |
| SCHEMBL5095980 | 0.79 | ABHD6 (0.44) | CYP1A2ABHD6HDAC1KDM4EALDH1A1 | |
| SCHEMBL4366306 | 0.79 | CYP1A2 (0.42) | CYP1A2PDE4BSTSPDE4APDE4C | |
| SCHEMBL4366303 | 0.79 | CYP1A2 (0.42) | CYP1A2PDE4BSTSPDE4APDE4C | |
| SCHEMBL4362160 | 0.78 | CYP1A2 (0.41) | CYP1A2PDE4BSTSPDE4APDE4C |
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-115806561-A | JAK3 selective inhibitors and uses thereof | 南京药石科技股份有限公司 | 2023-03-17 | — | — | CN | disclosed |