Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | PTGIR | P43119 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GRM7 | Q14831 | 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 | |
|---|---|---|---|---|
| SCHEMBL4629499 | 0.86 | HSP90AA1 (0.39) | HSP90AA1DRD2DRD3ALDH1A1GAA | |
| SCHEMBL4564019 | 0.86 | LMNA (0.38) | HSP90AA1ALDH1A1GAAL3MBTL1MEN1 | |
| SCHEMBL4556263 | 0.86 | ALDH1A1 (0.37) | HSP90AA1ALDH1A1GAAL3MBTL1CYP19A1 | |
| SCHEMBL4627927 | 0.86 | ALDH1A1 (0.37) | HSP90AA1ALDH1A1GAAL3MBTL1CYP19A1 | |
| SCHEMBL4564158 | 0.85 | HTR2B (0.36) | HSP90AA1ALDH1A1GAAL3MBTL1 | |
| SCHEMBL4564453 | 0.84 | HSP90AA1 (0.34) | HSP90AA1ALDH1A1GAAL3MBTL1HSD11B1 | |
| SCHEMBL4564188 | 0.84 | LTB4R (0.34) | HSP90AA1ALDH1A1GAAL3MBTL1CYP19A1 | |
| SCHEMBL4627857 | 0.84 | ALDH1A1 (0.32) | HSP90AA1ALDH1A1GAAL3MBTL1CYP3A4 | |
| SCHEMBL4658162 | 0.84 | HCRTR2 (0.36) | HSP90AA1ALDH1A1GAAL3MBTL1 | |
| SCHEMBL4658821 | 0.84 | HCRTR1 (0.32) | HSP90AA1DRD2DRD3ALDH1A1GAA |
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-2125825-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008079139-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-07-03 | — | — | WO | disclosed |
| 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 |