Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11020788 | 0.82 | LRRK2 (0.42) | ALDH1A1KDM4EGAAHPGDLMNA | |
| SCHEMBL11017001 | 0.78 | KDM4E (0.50) | ALDH1A1KDM4EGLAGAAHPGD | |
| SCHEMBL11019434 | 0.78 | HTT (0.42) | HTTALDH1A1KDM4EGLAGAA | |
| SCHEMBL11026081 | 0.78 | PARP1 (0.50) | ALDH1A1KDM4EGAAHPGDSMN1; SMN2 | |
| SCHEMBL11021063 | 0.76 | PIM1 (0.49) | HTTALDH1A1KDM4EGLAHPGD | |
| SCHEMBL29554478 | 0.75 | HTT (0.58) | HTTALDH1A1KDM4EGLAGAA | |
| SCHEMBL13946131 | 0.75 | HTT (0.58) | HTTALDH1A1KDM4EGLAGAA | |
| SCHEMBL11019342 | 0.72 | CHEK1 (0.38) | HTTALDH1A1KDM4EGLAGAA | |
| SCHEMBL22717589 | 0.72 | HTT (0.52) | HTTALDH1A1KDM4EGLAGAA | |
| SCHEMBL29574103 | 0.72 | HTT (0.52) | HTTALDH1A1KDM4EGLAGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0154190-A1 | Pyridones | MERCK PATENT GmbH (DE) | 1985-09-11 | — | — | EP | disclosed |