Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 4/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 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 | |
|---|---|---|---|---|
| SCHEMBL16321283 | 0.81 | CYP3A4 (0.60) | CYP3A4CYP2B6IDH1KDM1AMAOA | |
| SCHEMBL16321285 | 0.81 | CYP3A4 (0.60) | CYP3A4CYP2B6IDH1KDM1AMAOA | |
| SCHEMBL21667347 | 0.78 | CYP3A4 (0.50) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667306 | 0.78 | CYP3A4 (0.50) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL20716038 | 0.77 | CYP3A4 (0.61) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667176 | 0.77 | CYP3A4 (0.49) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667309 | 0.77 | CYP3A4 (0.49) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667374 | 0.77 | CYP3A4 (0.52) | CYP3A4CYP2B6ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL21667173 | 0.76 | LMNA (0.43) | CYP3A4CYP2B6LMNAMEN1KMT2A | |
| SCHEMBL21667252 | 0.75 | PDE9A (0.50) | CYP3A4CYP2B6ALDH1A1MEN1KMT2A |
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 |