Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6235516 | 0.92 | KDM4C (0.49) | ALDH1A1MAPTL3MBTL1PSEN1PSEN2 | |
| SCHEMBL6239726 | 0.86 | ALDH1A1 (0.46) | ALDH1A1MAPTL3MBTL1NPC1RAB9A | |
| SCHEMBL6985934 | 0.86 | MAPT (0.43) | ALDH1A1MAPTL3MBTL1PSEN1PSEN2 | |
| SCHEMBL6991899 | 0.86 | MAPT (0.51) | ALDH1A1MAPTL3MBTL1PSEN1PSEN2 | |
| SCHEMBL6989792 | 0.86 | MEN1 (0.45) | ALDH1A1MAPTL3MBTL1NPC1RAB9A | |
| SCHEMBL6990114 | 0.83 | LPAR1 (0.49) | ALDH1A1SLC2A1CA12CA1CA2 | |
| SCHEMBL6985928 | 0.79 | KDM5B (0.49) | ALDH1A1MAPTL3MBTL1KDM4EKDM6B | |
| SCHEMBL6239722 | 0.79 | KDM5B (0.49) | ALDH1A1MAPTL3MBTL1LPAR1LPAR5 | |
| SCHEMBL6993032 | 0.79 | KMT2A (0.49) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL6985002 | 0.78 | KDM4E (0.42) | ALDH1A1MAPTL3MBTL1LPAR1LPAR5 |
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 |