Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PDE7A | Q13946 | 13/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6254208 | 0.78 | KDM4E (0.43) | MAPTKDM4EALDH1A1NPC1HPGD | |
| SCHEMBL6239569 | 0.73 | KDM4E (0.49) | MAPTKDM4EALDH1A1HPGDTP53 | |
| SCHEMBL7100660 | 0.72 | KDM4E (0.36) | MAPTKDM4EALDH1A1HPGDTP53 | |
| SCHEMBL7096960 | 0.71 | MAPT (0.55) | MAPTKDM4EALDH1A1MAPK1NPC1 | |
| SCHEMBL6472654 | 0.70 | NPC1 (0.50) | MAPTKDM4EALDH1A1MAPK1NPC1 | |
| SCHEMBL6254956 | 0.69 | MAPT (0.56) | MAPTKDM4EALDH1A1MAPK1HPGD | |
| SCHEMBL22859390 | 0.68 | MAPT (0.51) | MAPTKDM4EALDH1A1MAPK1NPC1 | |
| SCHEMBL6257907 | 0.67 | KDM4E (0.42) | MAPTKDM4EALDH1A1NPC1HPGD | |
| SCHEMBL6256349 | 0.67 | KDM4E (0.36) | MAPTKDM4EALDH1A1NPC1HPGD | |
| SCHEMBL6730576 | 0.66 | TP53 (0.54) | MAPTKDM4EALDH1A1NPC1HTT |
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-1530467-A2 | COMBINATION OF AN ALLOSTERIC CARBOXYLIC INHIBITOR OF MATRIX METALLOPROTEINASE-13 WITH CELECOXIB OR VALDECOXIB | Warner-Lambert Company LLC (US) | 2005-05-18 | — | — | EP | disclosed |
| WO-2004006912-A2 | COMBINATION OF AN ALLOSTERIC CARBOXYLIC INHIBITOR OF MATRIX METALLOPROTEINASE-13 WITH CELECOXIB OR VALDECOXIB | WARNER-LAMBERT COMPANY LLC (US) | 2004-01-22 | — | — | WO | disclosed |