Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.37 |
| ▸ | KDM5A | P29375 | 2/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | KDM6B | O15054 | 1/20 | 0.37 |
| ▸ | TET3 | O43151 | 1/20 | 0.37 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
| ▸ | ASPH | Q12797 | 1/20 | 0.37 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.37 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.37 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.37 |
| ▸ | KDM7A | Q6ZMT4 | 1/20 | 0.37 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.37 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6239722 | 0.92 | KDM5B (0.49) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6985934 | 0.89 | MAPT (0.43) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6235518 | 0.86 | ALDH1A1 (0.49) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6989792 | 0.86 | MEN1 (0.45) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6990114 | 0.86 | LPAR1 (0.49) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL16569986 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6985928 | 0.82 | KDM5B (0.49) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6993032 | 0.81 | KMT2A (0.49) | ALDH1A1MAPK1KDM4ECA12CA1 | |
| SCHEMBL5808527 | 0.79 | ALDH1A1 (0.69) | ALDH1A1MAPTL3MBTL1KDM4CKDM5A | |
| SCHEMBL6989317 | 0.79 | SMN1; SMN2 (0.47) | MAPTCA1CA2CA9NPC1 |
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 |