Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.37 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 4/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL10363622 | 0.92 | CYP3A4 (0.38) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL10365542 | 0.87 | CYP3A4 (0.39) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL10364629 | 0.81 | CYP3A4 (0.44) | CYP3A4TBXAS1BAZ2BPDE4APDE4B | |
| SCHEMBL10363602 | 0.77 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL10759770 | 0.75 | TBXAS1 (0.58) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8828166 | 0.72 | CYP3A4 (0.36) | CYP3A4CYP19A1TBXAS1BAZ2BPDE4A | |
| SCHEMBL28061806 | 0.69 | CYP3A4 (0.50) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL1944624 | 0.68 | NAMPT (0.51) | SMN1; SMN2HTTKDM4EALDH1A1MAPT | |
| SCHEMBL10365503 | 0.68 | CYP3A4 (0.40) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL10761593 | 0.67 | TBXAS1 (0.57) | CYP3A4CYP2D6CYP1A2CYP19A1CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0175187-B1 | 3,4-DIHYDRO-2(1H)-PYRIDONES AND 2(1H)-PYRIDONES CONTAINING IMIDAZOLE GROUPS, METHOD FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | A. Nattermann & Cie. GmbH (DE) | 1990-01-10 | — | — | EP | disclosed |
| US-4699914-A | CONGESTIVE HEART FAILURE | A. NATTERMANN & CIE GMBH (DE) | 1987-10-13 | — | — | US | disclosed |
| EP-0175187-A1 | 3,4-Dihydro-2(1H)-pyridones and 2(1H)-pyridones containing imidazole groups, method for their preparation and medicaments containing them | A. Nattermann & Cie. GmbH (DE) | 1986-03-26 | — | — | EP | disclosed |