Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.30 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.30 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11095062 | 0.75 | PDE3B (0.38) | PDE3BPDE3APDE4APDE4BPDE4C | |
| SCHEMBL10648314 | 0.74 | PDE3B (0.60) | CYP3A4PDE3BPDE3ALMNACYP1A2 | |
| SCHEMBL11094601 | 0.73 | CYP3A4 (0.56) | CYP3A4PDE3BPDE3ALMNACYP1A2 | |
| SCHEMBL10727551 | 0.73 | PDE3B (0.36) | CYP3A4PDE3BPDE3ALMNACYP1A2 | |
| SCHEMBL28061806 | 0.72 | CYP3A4 (0.50) | CYP3A4LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11104630 | 0.70 | CYP3A4 (0.34) | CYP3A4PDE3BPDE3ALMNATSHR | |
| SCHEMBL27958208 | 0.69 | CYP11B1 (0.54) | CYP3A4LMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL11104830 | 0.67 | PDE3B (0.36) | CYP3A4PDE3BPDE3ALMNACYP1A2 | |
| SCHEMBL10651787 | 0.65 | PDE3B (0.63) | CYP3A4PDE3BPDE3ALMNACYP1A2 | |
| SCHEMBL29241982 | 0.65 | CYP3A4 (0.42) | CYP3A4LMNACYP1A2CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0122419-A2 | Substituted 3-mercaptopyridazines, their 3-alkylthio derivatives and processes for their preparation | A. Nattermann & Cie. GmbH (DE) | 1984-10-24 | — | — | EP | disclosed |