Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30723324 | 0.90 | KDM4E (0.38) | HRH3KCNH2ADRA1AMAPTL3MBTL1 | |
| SCHEMBL30723309 | 0.89 | MAPK1 (0.39) | TRPV4HRH3KCNH2MAPTL3MBTL1 | |
| SCHEMBL30723305 | 0.88 | MAPT (0.40) | HRH3KCNH2ADRA1AHTR2CHTR7 | |
| SCHEMBL30723322 | 0.88 | MAPT (0.36) | TRPV4MAPTL3MBTL1BCHEACHE | |
| SCHEMBL30723313 | 0.87 | CYP1A1 (0.43) | HRH3KCNH2HTR7HTR2BHTR4 | |
| SCHEMBL30723336 | 0.84 | HRH3 (0.37) | HRH3KCNH2BCHEACHEKDM4E | |
| SCHEMBL30723331 | 0.84 | KMT2A (0.34) | MAPTL3MBTL1BCHEACHEKDM4E | |
| SCHEMBL30723314 | 0.84 | ACHE (0.54) | MAPTL3MBTL1BCHEACHEKDM4E | |
| SCHEMBL30723337 | 0.82 | KMT2A (0.36) | HRH3BCHEACHEKDM4ESMN1; SMN2 | |
| SCHEMBL30723308 | 0.80 | GAA (0.39) | TRPV4HRH3KCNH2HTR7HTR4 |
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-117486887-A | Polycyclic pyrimidine-4-ketone compound and preparation method and application thereof | 昆明学院 | 2024-02-02 | — | — | CN | disclosed |