Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 2/20 | 0.48 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20506971 | 0.82 | PDE10A (0.32) | CNR2CNR1LMNAALDH1A1 | |
| SCHEMBL29211992 | 0.75 | SHMT2 (0.39) | MAPTSMN1; SMN2ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL16478319 | 0.72 | MAP2K1 (0.41) | HTT | |
| SCHEMBL10461765 | 0.71 | CSNK2A1 (0.33) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL29212016 | 0.71 | ICMT (0.39) | ALDH1A1NPC1RAB9A | |
| SCHEMBL23121804 | 0.70 | TYR (0.42) | CNR2CNR1TYRSMN1; SMN2TNF | |
| SCHEMBL17247762 | 0.70 | MAPT (0.46) | CNR2CNR1TYRMAPTLMNA | |
| SCHEMBL30874702 | 0.68 | GRM2 (0.37) | TYRSMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL20709986 | 0.67 | CNR1 (0.40) | CNR2CNR1TYRMAPTLMNA | |
| SCHEMBL29161587 | 0.67 | CNR1 (0.37) | CNR2CNR1TYRMAPTLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117886801-B | Pyridone pyrimidine CDK inhibitor, and preparation method and application thereof | 中国药科大学 | 2024-05-17 | — | — | CN | disclosed |
| CN-117886801-A | Pyridone pyrimidine CDK inhibitor, and preparation method and application thereof | 中国药科大学 | 2024-04-16 | — | — | CN | disclosed |