Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 9/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6237834 | 0.81 | HSD17B10 (0.45) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6261894 | 0.80 | KDM4E (0.41) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6727703 | 0.78 | MMP13 (0.42) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6257907 | 0.75 | KDM4E (0.42) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6237897 | 0.75 | KDM4E (0.45) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6254318 | 0.73 | KDM4E (0.43) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6255590 | 0.71 | KDM4E (0.41) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6256349 | 0.71 | KDM4E (0.36) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL6257382 | 0.70 | BRD4 (0.48) | HSD17B10KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL7100660 | 0.69 | KDM4E (0.36) | HSD17B10KDM4EALDH1A1MAPTHPGD |
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 |