Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 8/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | OGG1 | O15527 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28899847 | 0.88 | SLC22A12 (0.48) | SLC22A12CYP1A2CYP2C9CYP2C19ABCG2 | |
| SCHEMBL28899774 | 0.84 | SLC22A12 (0.58) | SLC22A12CYP1A2CYP2C9CYP2C19PDE5A | |
| SCHEMBL30104172 | 0.83 | SLC22A12 (0.61) | SLC22A12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28899935 | 0.83 | SLC22A12 (0.65) | SLC22A12KDM4EABCG2MEN1LMNA | |
| SCHEMBL30104166 | 0.82 | SLC22A12 (0.46) | SLC22A12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28899873 | 0.79 | SLC22A12 (0.48) | SLC22A12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29259538 | 0.79 | SLC22A12 (0.61) | SLC22A12CYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL30104157 | 0.77 | SLC22A12 (0.41) | SLC22A12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28899921 | 0.77 | SLC22A12 (0.41) | SLC22A12CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL30104155 | 0.74 | SLC22A12 (0.57) | SLC22A12CYP1A2CYP2C9CYP2C19 |
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-115417825-B | Five-membered or six-membered fused ring pyrimidine cyclopropyl naphthalene derivative and preparation method and application thereof | 山东大学 | 2024-06-28 | — | — | CN | disclosed |
| CN-115417825-A | Five-membered or six-membered fused ring pyrimidine cyclopropyl naphthalene derivative and preparation method and application thereof | 山东大学 | 2022-12-02 | — | — | CN | disclosed |