Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL23534223 | 0.90 | CYP3A4 (0.48) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL15437816 | 0.88 | LMNA (0.51) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL348867 | 0.87 | KDM4E (0.53) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL349998 | 0.87 | KDM4E (0.53) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL28964761 | 0.87 | L3MBTL1 (0.53) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL18896634 | 0.84 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL15592014 | 0.84 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL18896637 | 0.84 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL15592013 | 0.84 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL4807305 | 0.78 | KDM4E (0.51) | GAALMNAKDM4EKMT2AALDH1A1 |
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-115734966-A | Heterocyclic compounds and their use | 石药集团中奇制药技术（石家庄）有限公司 | 2023-03-03 | — | — | CN | disclosed |