Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 10/20 | 0.37 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776487 | 1.00 | PDE5A (0.38) | PDE5ASPHK1VCPADORA1NOS3 | |
| SCHEMBL4796379 | 1.00 | PDE5A (0.38) | PDE5ASPHK1VCPADORA1NOS3 | |
| SCHEMBL4780605 | 0.90 | BRAF (0.38) | PDE5AADORA1NOS3NOS1NOS2 | |
| SCHEMBL14303801 | 0.88 | KDM4E (0.40) | KDM4EALDH1A1EPHX2 | |
| SCHEMBL4780429 | 0.87 | MOK (0.42) | ADORA1KDM4EALDH1A1EPHX2 | |
| SCHEMBL4776439 | 0.85 | SPHK1 (0.35) | PDE5ASPHK1ALDH1A1 | |
| SCHEMBL4796206 | 0.85 | SPHK1 (0.37) | SPHK1VCPNOS3NOS1NOS2 | |
| SCHEMBL4774100 | 0.83 | NOS3 (0.42) | PDE5AVCPADORA1NOS3NOS1 | |
| SCHEMBL4776564 | 0.83 | TACR1 (0.37) | PDE5ASPHK1 | |
| SCHEMBL4778365 | 0.82 | PDE5A (0.40) | PDE5AVCPADORA1NOS3NOS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |