Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 20/20 | 0.78 |
| ▸ | HDAC1 | Q13547 | 19/20 | 0.78 |
| ▸ | HDAC6 | Q9UBN7 | 19/20 | 0.78 |
| ▸ | HDAC2 | Q92769 | 16/20 | 0.78 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.78 |
| ▸ | NCOR2 | Q9Y618 | 6/20 | 0.78 |
| ▸ | PDE9A | O76083 | 1/20 | 0.54 |
| ▸ | PDE6C | P51160 | 1/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL17404873 | 0.88 | PDE5A (1.00) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003779 | 0.87 | PDE5A (0.78) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003782 | 0.87 | PDE5A (0.71) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003768 | 0.86 | PDE5A (0.78) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003673 | 0.83 | PDE5A (0.78) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL18714953 | 0.81 | PDE5A (0.67) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003681 | 0.79 | PDE5A (0.72) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003668 | 0.78 | PDE5A (0.71) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003914 | 0.76 | HDAC6 (0.49) | PDE5AHDAC1HDAC6HDAC2HDAC3 | |
| SCHEMBL16003916 | 0.76 | PDE5A (0.72) | PDE5AHDAC1HDAC6HDAC2HDAC3 |
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-2014131855-A1 | NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES | FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) | 2014-09-04 | — | — | WO | disclosed |