Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.56 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE1A | P54750 | 1/20 | 0.44 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7945286 | 0.87 | PDCD1 (0.43) | PDCD1CD274CYP11B1CYP11B2ERN1 | |
| SCHEMBL7944717 | 0.86 | CYP11B1 (0.45) | PDCD1CD274CYP11B1CYP11B2CYP1A2 | |
| SCHEMBL8017441 | 0.84 | PDCD1 (0.61) | PDCD1CD274CYP11B1CYP11B2PDE5A | |
| SCHEMBL8028294 | 0.80 | PDCD1 (0.58) | PDCD1CD274ERN1PDE5APDE4A | |
| SCHEMBL4050630 | 0.80 | PDCD1 (0.52) | PDCD1CD274CYP11B1CYP11B2PDE5A | |
| SCHEMBL238087 | 0.79 | APLNR (0.63) | PDCD1CD274PDE4APDE4BPDE4C | |
| Methylene Chloride SCHEMBL28275708 | 0.78 | APLNR (0.58) | PDCD1CD274PDE4APDE4BPDE4C | |
| SCHEMBL5753110 | 0.78 | ALDH1A1 (0.54) | CYP11B1CYP11B2APLNRKDM4EALDH1A1 | |
| SCHEMBL28303202 | 0.77 | ESR2 (0.57) | CYP1A2CYP3A4CYP2D6CYP2C19CYP1A1 | |
| SCHEMBL12325069 | 0.76 | HSP90AA1 (0.56) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 |
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-2009071504-A1 | 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-11 | — | — | WO | disclosed |