Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | HSPA9 | P38646 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4564019 | 0.85 | LMNA (0.38) | HCRTR2GAAL3MBTL1ALDH1A1CTSD | |
| SCHEMBL4564341 | 0.84 | HSD11B1 (0.39) | LMNA | |
| SCHEMBL4564085 | 0.84 | HSP90AA1 (0.39) | GAAL3MBTL1ALDH1A1HSP90AA1 | |
| SCHEMBL4657250 | 0.82 | LMNA (0.38) | HCRTR2GAAL3MBTL1ALDH1A1CTSD | |
| SCHEMBL4657674 | 0.82 | NR1H3 (0.37) | GAAL3MBTL1ALDH1A1LMNA | |
| SCHEMBL4629499 | 0.82 | HSP90AA1 (0.39) | GAAL3MBTL1ALDH1A1LMNAHSP90AA1 | |
| SCHEMBL4556263 | 0.81 | ALDH1A1 (0.37) | GAAL3MBTL1ALDH1A1NPSR1LMNA | |
| SCHEMBL4627927 | 0.81 | ALDH1A1 (0.37) | GAAL3MBTL1ALDH1A1NPSR1LMNA | |
| SCHEMBL4564158 | 0.81 | HTR2B (0.36) | GAAL3MBTL1ALDH1A1BACE1TMEM97 | |
| SCHEMBL4564188 | 0.80 | LTB4R (0.34) | GAAL3MBTL1ALDH1A1HSP90AA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1907395-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-04-09 | — | — | EP | claimed |
| WO-2007002867-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2007-01-04 | — | — | WO | claimed |
| EP-1907395-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-04-09 | — | — | EP | disclosed |
| WO-2007002867-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2007-01-04 | — | — | WO | disclosed |