Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29152982 | 0.92 | HSD17B10 (0.45) | ALDH1A1KDM4ESMN1; SMN2LMNACASP1 | |
| SCHEMBL30723298 | 0.90 | SMN1; SMN2 (0.43) | ALDH1A1KDM4ESMN1; SMN2CASP1HSD17B10 | |
| SCHEMBL30723318 | 0.88 | KMT2A (0.43) | ALDH1A1KDM4ESMN1; SMN2HPGDMAPT | |
| SCHEMBL30723299 | 0.88 | ATM (0.46) | ALDH1A1KDM4ESMN1; SMN2LMNACYP1A2 | |
| SCHEMBL30723297 | 0.87 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2LMNACASP1 | |
| SCHEMBL30723314 | 0.86 | ACHE (0.54) | ALDH1A1KDM4ESMN1; SMN2HPGDCYP1A2 | |
| SCHEMBL30723311 | 0.84 | CYP2C9 (0.37) | ALDH1A1KDM4ESMN1; SMN2LMNACASP1 | |
| SCHEMBL30723302 | 0.84 | MEN1 (0.38) | ALDH1A1KDM4ESMN1; SMN2LMNACASP1 | |
| SCHEMBL30723337 | 0.84 | KMT2A (0.36) | ALDH1A1KDM4ESMN1; SMN2HTTKMT2A | |
| SCHEMBL30723323 | 0.83 | MAPK1 (0.48) | ALDH1A1KDM4ESMN1; SMN2LMNACYP1A1 |
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 |