Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | TRPV3 | Q8NET8 | 3/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL29635376 | 0.78 | PDE10A (0.43) | PDE10ATRPV3CASP3TRPV4CHEK1 | |
| SCHEMBL22042748 | 0.78 | PDE10A (0.43) | PDE10ATRPV3CASP3TRPV4CHEK1 | |
| SCHEMBL30969081 | 0.78 | PDE10A (0.43) | PDE10ATRPV3CASP3TRPV4CHEK1 | |
| SCHEMBL30151270 | 0.73 | MAPT (0.43) | KMT2AKDM4E | |
| SCHEMBL30151235 | 0.71 | PTGS1 (0.40) | PDE10ATRPV3CASP3TRPV4PIK3CD | |
| SCHEMBL30151240 | 0.71 | PTGS1 (0.40) | PDE10ATRPV3CASP3TRPV4PIK3CD | |
| SCHEMBL25180910 | 0.71 | CCR1 (0.42) | PDE10AAURKAKDRAURKBKMT2A | |
| SCHEMBL5746444 | 0.71 | CASP3 (0.45) | TRPV3CASP3TRPV4PIK3CDPIK3CA | |
| SCHEMBL9155754 | 0.70 | KDM4E (0.49) | PDE10AKMT2ATRPV4KDM4EPIK3CA | |
| SCHEMBL31414063 | 0.70 | KDM4E (0.49) | PDE10AKMT2ATRPV4KDM4EPIK3CA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023085142-A1 | FLUORINE-CONTAINING PYRIMIDINE COMPOUNDS, HARMFUL FUNGI CONTROL AGENT, AND METHOD FOR PRODUCING FLUORINE-CONTAINING PYRIMIDINE COMPOUNDS | ユニマテック株式会社 | 2023-05-19 | — | — | WO | disclosed |