Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.48 |
| ▸ | PDE6C | P51160 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | PDE9A | O76083 | 2/20 | 0.46 |
| ▸ | FABP4 | P15090 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21667252 | 0.87 | PDE9A (0.50) | CYP3A4CYP2B6PDE9AALDH1A1MAPT | |
| SCHEMBL21667332 | 0.85 | CYP3A4 (0.49) | CYP3A4CYP2B6ALDH1A1MAPTMEN1 | |
| SCHEMBL20716038 | 0.84 | CYP3A4 (0.61) | CYP3A4CYP2B6PDE9AALDH1A1MAPT | |
| SCHEMBL21667198 | 0.84 | CYP3A4 (0.50) | CYP3A4CYP2B6MAPTMEN1KMT2A | |
| SCHEMBL16322372 | 0.79 | CYP3A4 (0.72) | CYP3A4CYP2B6ALDH1A1MAPK1HTT | |
| SCHEMBL16322373 | 0.79 | CYP3A4 (0.72) | CYP3A4CYP2B6ALDH1A1MAPK1HTT | |
| SCHEMBL21667335 | 0.78 | CYP3A4 (0.51) | CYP3A4CYP2B6PDE9AALDH1A1MAPT | |
| SCHEMBL21667347 | 0.78 | CYP3A4 (0.50) | CYP3A4CYP2B6PDE9AALDH1A1MEN1 | |
| SCHEMBL21667306 | 0.78 | CYP3A4 (0.50) | CYP3A4CYP2B6PDE9AFABP4ALDH1A1 | |
| SCHEMBL21667309 | 0.77 | CYP3A4 (0.49) | CYP3A4CYP2B6PDE9AALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3702352-A1 | PYRIMIDINEDIONE COMPOUND AGAINST CARDIAC CONDITIONS | Myokardia, Inc. (US) | 2020-09-02 | — | — | EP | disclosed |
| EP-3010910-B1 | PYRIMIDINEDIONE COMPOUNDS AGAINST CARDIAC CONDITIONS | MYOKARDIA INC (US) | 2020-02-05 | — | — | EP | disclosed |