Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 2/20 | 0.45 |
| ▸ | CPT1A | P50416 | 3/20 | 0.45 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.44 |
| ▸ | CPT2 | P23786 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 11/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.42 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28920434 | 0.94 | STS (0.44) | STSCPT1AHTR6CYP2C9HDAC1 | |
| SCHEMBL28920511 | 0.90 | MAPT (0.46) | STSPOLBDUSP3PTPN5PTPN11 | |
| SCHEMBL28920492 | 0.90 | CCNT1 (0.46) | HTR6 | |
| SCHEMBL28920384 | 0.90 | HTR6 (0.43) | HTR6 | |
| SCHEMBL28920435 | 0.90 | HTR6 (0.45) | CPT1ACPT1BCPT2HTR6CYP2C9 | |
| SCHEMBL30091124 | 0.86 | HTR6 (0.47) | CPT1ACPT1BCPT2HTR6POLB | |
| SCHEMBL30091257 | 0.86 | HTR6 (0.55) | CPT1AHTR6POLBDUSP3PTPN5 | |
| SCHEMBL28920456 | 0.86 | HTR6 (0.55) | CPT1AHTR6POLBDUSP3PTPN5 | |
| SCHEMBL28920487 | 0.85 | HTR6 (0.43) | HTR6 | |
| SCHEMBL30091180 | 0.84 | HTR6 (0.60) | HTR6 |
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-109232362-B | Aromatic heterocyclic derivative and application thereof in medicines | 广东东阳光药业有限公司 | 2022-12-27 | — | — | CN | disclosed |