Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | TRPV3 | Q8NET8 | 3/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22042748 | 1.00 | PDE10A (0.43) | PDE10ACHEK1TRPV3CASP3KDM5B | |
| SCHEMBL30969081 | 1.00 | PDE10A (0.43) | PDE10ACHEK1TRPV3CASP3KDM5B | |
| SCHEMBL29635363 | 0.86 | HDAC1 (0.41) | HDAC1HDAC6HDAC5 | |
| SCHEMBL22042756 | 0.86 | HDAC1 (0.36) | PDE10ACHEK1HDAC1HDAC6HDAC5 | |
| SCHEMBL22042711 | 0.86 | HDAC1 (0.41) | HDAC1HDAC6HDAC5 | |
| SCHEMBL29635368 | 0.86 | HDAC1 (0.36) | PDE10ACHEK1HDAC1HDAC6HDAC5 | |
| SCHEMBL30969065 | 0.86 | HDAC1 (0.41) | HDAC1HDAC6HDAC5 | |
| SCHEMBL30421024 | 0.86 | HDAC1 (0.36) | PDE10ACHEK1HDAC1HDAC6HDAC5 | |
| SCHEMBL30151270 | 0.81 | MAPT (0.43) | — | |
| SCHEMBL22042751 | 0.81 | S1PR1 (0.38) | HDAC1HDAC6HDAC5 |
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-112739689-B | Fluorine-containing pyrimidine compound and method for producing same | 优迈特株式会社 | 2022-06-03 | — | — | CN | disclosed |