Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6454939 | 0.91 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2905913 | 0.91 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| Methylmalonic Acid SCHEMBL8428740 | 0.77 | TP53 (0.42) | CYP1A2LMNA | |
| SCHEMBL10802104 | 0.74 | GABRP (0.33) | LMNA | |
| SCHEMBL4351050 | 0.73 | LMNA (0.36) | LMNA | |
| SCHEMBL10975192 | 0.73 | LMNA (0.36) | LMNA | |
| SCHEMBL4351053 | 0.73 | LMNA (0.36) | LMNA | |
| SCHEMBL2416426 | 0.72 | KDM4E (0.33) | — | |
| SCHEMBL346751 | 0.72 | KDM4E (0.33) | — | |
| SCHEMBL346752 | 0.72 | KDM4E (0.33) | — |
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-107223146-B | Water-dispersible polyamide structural units | 路博润先进材料公司 | 2020-08-07 | — | — | CN | disclosed |