Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE9A | O76083 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21667381 | 0.87 | PDE5A (0.48) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL21667347 | 0.84 | CYP3A4 (0.50) | PDE9ACYP3A4CYP2B6ALDH1A1SMN1; SMN2 | |
| SCHEMBL21667306 | 0.84 | CYP3A4 (0.50) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL20716038 | 0.84 | CYP3A4 (0.61) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL21667176 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2B6ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL21667309 | 0.83 | CYP3A4 (0.49) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL21667374 | 0.83 | CYP3A4 (0.52) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL21667329 | 0.81 | GRM2 (0.52) | PDE9AALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL21667335 | 0.78 | CYP3A4 (0.51) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT | |
| SCHEMBL21667270 | 0.78 | KMT2A (0.64) | PDE9ACYP3A4CYP2B6ALDH1A1MAPT |
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 |