Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.51 |
| ▸ | PDE9A | O76083 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21667323 | 0.84 | CYP3A4 (0.54) | CYP3A4CYP2B6KMT2AMEN1P2RX7 | |
| SCHEMBL21667279 | 0.84 | CYP3A4 (0.54) | CYP3A4CYP2B6PDE9AKMT2AALDH1A1 | |
| SCHEMBL21667337 | 0.83 | CYP3A4 (0.53) | CYP3A4CYP2B6KMT2AMEN1ALDH1A1 | |
| SCHEMBL21667350 | 0.83 | CYP3A4 (0.53) | CYP3A4CYP2B6KMT2AMEN1ALDH1A1 | |
| SCHEMBL21667318 | 0.80 | CYP3A4 (0.50) | CYP3A4CYP2B6P2RX7ALDH1A1L3MBTL1 | |
| SCHEMBL21667363 | 0.80 | CYP3A4 (0.50) | CYP3A4CYP2B6P2RX7ABL1SRC | |
| SCHEMBL20716038 | 0.80 | CYP3A4 (0.61) | CYP3A4CYP2B6PDE9AKMT2AMEN1 | |
| SCHEMBL21667339 | 0.80 | CYP3A4 (0.46) | CYP3A4CYP2B6KMT2AMEN1P2RX7 | |
| SCHEMBL21667381 | 0.78 | PDE5A (0.48) | CYP3A4CYP2B6PDE9AKMT2AMEN1 | |
| SCHEMBL16322304 | 0.78 | CYP3A4 (0.67) | CYP3A4CYP2B6KMT2AHTTL3MBTL1 |
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 |