Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL4383858 | 0.84 | KDM4E (0.46) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL4390061 | 0.83 | CYP1A2 (0.40) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL4390064 | 0.83 | CYP1A2 (0.40) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL7987718 | 0.81 | PLA2G4B (0.46) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL7991257 | 0.81 | CYP3A4 (0.45) | CYP1A2CYP2D6SMN1; SMN2KDM4ELMNA | |
| SCHEMBL4383468 | 0.81 | KDM4E (0.44) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL4384962 | 0.80 | KDM4E (0.38) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL4384958 | 0.80 | KDM4E (0.38) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A | |
| SCHEMBL4386689 | 0.78 | LMNA (0.45) | CYP1A2CYP2D6SMN1; SMN2KDM4ELMNA | |
| SCHEMBL4378580 | 0.78 | KDM4E (0.43) | CYP1A2CYP2D6SMN1; SMN2KDM4EPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| US-6248765-B1 | ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) | 2001-06-19 | — | — | US | claimed |