Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 9/20 | 0.85 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NT5E | P21589 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL519087 | 0.92 | PDE10A (1.00) | PDE10AALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2750426 | 0.92 | PDE10A (0.92) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| SCHEMBL2529075 | 0.91 | PDE10A (0.86) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| Hydrogen Sulfide SCHEMBL27824224 | 0.91 | PDE10A (0.98) | PDE10AALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2532142 | 0.90 | PDE10A (0.85) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| SCHEMBL2497080 | 0.90 | PDE10A (0.85) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| SCHEMBL2498041 | 0.90 | PDE10A (0.88) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| SCHEMBL7909398 | 0.90 | PDE10A (0.68) | PDE10AALDH1A1NPSR1CYP2C9 | |
| SCHEMBL2509403 | 0.90 | PDE10A (0.80) | PDE10AALDH1A1KDM4EHPGDNPSR1 | |
| SCHEMBL2749131 | 0.89 | PDE10A (0.83) | PDE10AALDH1A1KDM4EHPGDNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010063610-A1 | PYRIDAZINONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-06-10 | — | — | WO | disclosed |