Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MMP12 | P39900 | 2/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6237897 | 0.84 | KDM4E (0.45) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6237834 | 0.82 | HSD17B10 (0.45) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6261894 | 0.80 | KDM4E (0.41) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6254318 | 0.80 | KDM4E (0.43) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6255590 | 0.78 | KDM4E (0.41) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6256349 | 0.77 | KDM4E (0.36) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL7100660 | 0.76 | KDM4E (0.36) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6259014 | 0.75 | HSD17B10 (0.38) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6254208 | 0.75 | KDM4E (0.43) | KDM4EHSD17B10ALDH1A1MAPTHPGD | |
| SCHEMBL6730293 | 0.74 | LMNA (0.49) | KDM4EHSD17B10ALDH1A1MAPTHPGD |
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 |