Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL4778374 | 0.90 | NOS3 (0.38) | NOS3NOS1NOS2MAOBPDE5A | |
| SCHEMBL4774580 | 0.85 | GRIN2B (0.40) | RAB9AALDH1A1MEN1LMNAMAPT | |
| SCHEMBL4776439 | 0.85 | SPHK1 (0.35) | PDE5AALDH1A1LMNAMAPTMCHR1 | |
| SCHEMBL4774100 | 0.82 | NOS3 (0.42) | NOS3NOS1NOS2MAOBPDE5A | |
| SCHEMBL4778323 | 0.81 | NOS3 (0.43) | NOS3NOS1NOS2MAOBPDE5A | |
| SCHEMBL4794914 | 0.80 | ADRA2A (0.45) | — | |
| SCHEMBL4774754 | 0.76 | PDE5A (0.41) | NOS3NOS1NOS2PDE5AKMT2A | |
| SCHEMBL4780410 | 0.76 | NOS3 (0.44) | NOS3NOS1NOS2PDE5AKMT2A | |
| SCHEMBL4779107 | 0.73 | PDE5A (0.47) | NOS3NOS1NOS2PDE5AALDH1A1 | |
| SCHEMBL4778076 | 0.73 | PDE5A (0.40) | NOS3NOS1NOS2PDE5AALDH1A1 |
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-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |