Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1B | Q01064 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.47 |
| ▸ | MELK | Q14680 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3456723 | 0.93 | MAPT (0.50) | PDE1BHDAC1HDAC6HDAC11HDAC8 | |
| SCHEMBL2774113 | 0.87 | AGTR1 (0.48) | HDAC1HDAC6HDAC11HDAC8TP53 | |
| SCHEMBL13070234 | 0.84 | AGTR1 (0.54) | PDE1BHDAC1HDAC6HDAC11HDAC8 | |
| SCHEMBL2776910 | 0.73 | AGTR1 (0.54) | PDE1BHDAC1HDAC6HDAC11HDAC8 | |
| SCHEMBL17483612 | 0.72 | PDE1B (0.76) | PDE1B | |
| SCHEMBL2774771 | 0.71 | AGTR1 (0.54) | AGTR1 | |
| SCHEMBL18808388 | 0.70 | PDE1B (0.52) | PDE1B | |
| SCHEMBL24031181 | 0.69 | THRB (0.71) | HDAC1HDAC6HDAC11HDAC8TP53 | |
| SCHEMBL2773612 | 0.69 | AGTR1 (0.73) | AGTR1 | |
| SCHEMBL2774054 | 0.68 | HDAC1 (0.60) | PDE1BHDAC1HDAC6HDAC11HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2253630-A1 | Heterocyclic compound and use thereof | Takeda Pharmaceutical Company Limited (JP) | 2010-11-24 | — | — | EP | disclosed |