Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | APLNR | P35414 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7970192 | 0.79 | LMNA (0.55) | ALDH1A1SMN1; SMN2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL19487245 | 0.78 | LMNA (0.77) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL13167712 | 0.78 | APLNR (0.68) | ALDH1A1SMN1; SMN2KMT2AMEN1TSHR | |
| SCHEMBL22495599 | 0.78 | TLR8 (0.49) | POLBPDE7AAPLNR | |
| SCHEMBL29832372 | 0.75 | PDE7A (0.69) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL290649 | 0.75 | PDE7A (0.69) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL9972171 | 0.74 | LMNA (0.74) | ALDH1A1SMN1; SMN2CYP3A4CYP2C9LMNA | |
| SCHEMBL13407758 | 0.73 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2CYP2C9LMNAKMT2A | |
| SCHEMBL12297914 | 0.73 | ALDH1A1 (0.92) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL9381788 | 0.72 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2CYP2C9LMNAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001034576-A2 | USE OF PYRIMIDINONE DERIVATIVES FOR CONTROLLING UNDESIRED MICROORGANISMS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-05-17 | — | — | WO | disclosed |