Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16637307 | 0.89 | HSD17B10 (0.52) | SMN1; SMN2ADORA2BMAPTRAB9AKDM4E | |
| SCHEMBL7018700 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2LMNANPSR1ADORA2BMAPT | |
| SCHEMBL7025417 | 0.82 | ADORA2B (0.40) | SMN1; SMN2ADORA2BMAPK8MAPTRAB9A | |
| SCHEMBL7021004 | 0.80 | L3MBTL1 (0.46) | SMN1; SMN2ADORA2BMAPTRAB9AKDM4E | |
| SCHEMBL6236551 | 0.80 | ADORA2B (0.39) | SMN1; SMN2ADORA2BMAPTRAB9AKDM4E | |
| SCHEMBL2774966 | 0.80 | ADORA2B (0.58) | SMN1; SMN2ADORA2BMAPTRAB9AKDM4E | |
| SCHEMBL7033820 | 0.79 | ALDH1A1 (0.44) | SMN1; SMN2LMNAMAPTRAB9AKDM4E | |
| SCHEMBL2775047 | 0.79 | ADORA2B (0.54) | SMN1; SMN2LMNAADORA2BMAPTRAB9A | |
| SCHEMBL6513715 | 0.78 | ALDH1A1 (0.50) | SMN1; SMN2LMNAMAPTKDM4EKMT2A | |
| SCHEMBL6253161 | 0.77 | HPGD (0.52) | SMN1; SMN2LMNANPSR1MAPTKDM4E |
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 |