Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 5/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12108285 | 0.89 | PDE4B (0.50) | PDE4BHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1302302 | 0.82 | PDE4B (0.70) | PDE4BHDAC8CYP17A1CYP19A1CYP11B1 | |
| SCHEMBL12108282 | 0.82 | PDE4B (0.70) | PDE4BCYP17A1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL1301536 | 0.76 | PDE4B (0.49) | PDE4BCYP17A1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL1301467 | 0.72 | PDE4B (0.53) | PDE4BMAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL1301614 | 0.72 | PDE4B (0.66) | PDE4BCYP17A1CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL1301623 | 0.71 | PDE4B (0.56) | PDE4BMAOAKDM4ENPC1ALDH1A1 | |
| SCHEMBL1301436 | 0.71 | PDE4B (0.64) | PDE4BCYP19A1MAPTKDM4ENPC1 | |
| SCHEMBL1302356 | 0.71 | PDE4B (0.69) | PDE4BMAOAKDM4ENPC1ALDH1A1 | |
| SCHEMBL12108224 | 0.71 | PDE4B (0.51) | PDE4BCYP17A1CYP19A1CYP11B1CYP11B2 |
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-2010084402-A2 | HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2010-07-29 | — | — | WO | disclosed |